data_2ltl_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 2ltl _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.9 mt . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 107.478 -1.305 . . . . 72.52 107.478 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -64.88 124.7 22.7 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 123.75 0.656 . . . . 74.42 109.725 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.438 ' HB ' HG22 ' A' ' 102' ' ' ILE . 50.3 mm -116.03 127.37 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 N-CA-C 107.313 -1.366 . . . . 73.53 107.313 -174.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -93.63 150.13 20.67 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 108.494 -0.928 . . . . 74.3 108.494 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.9 t -141.28 112.23 7.22 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.695 0.798 . . . . 75.24 109.233 173.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.8 mt -99.65 138.97 35.99 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 124.075 0.95 . . . . 72.32 110.33 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.0 p -80.22 140.2 36.38 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 123.748 0.655 . . . . 72.34 109.453 176.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 63.9 p -107.09 166.08 11.7 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.539 1.136 . . . . 73.34 108.712 -176.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.71 -7.93 19.67 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.375 2.05 . . . . 75.12 112.743 169.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -82.65 151.14 26.42 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.222 1.009 . . . . 74.33 111.628 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -89.4 -31.58 17.68 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.086 0.954 . . . . 72.12 112.357 -171.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -121.82 2.3 9.99 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.269 0.627 . . . . 75.31 111.921 -174.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -112.54 137.53 50.64 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.91 0.484 . . . . 64.05 110.121 177.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.4 tp -136.99 134.59 36.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.993 0.517 . . . . 72.53 109.958 177.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.578 ' HE2' HD11 ' A' ' 33' ' ' LEU . 88.6 tttt -92.2 120.34 32.68 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.296 1.038 . . . . 73.53 110.629 -175.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -109.81 109.04 19.58 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.296 -1.002 . . . . 73.32 108.296 173.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.578 HD11 ' HE2' ' A' ' 31' ' ' LYS . 4.5 tt -111.94 134.18 53.66 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.366 -0.976 . . . . 75.52 108.366 -175.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.3 m -85.93 111.96 20.73 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.278 0.631 . . . . 63.25 110.006 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.501 HG22 HD22 ' A' ' 33' ' ' LEU . 26.3 p -135.21 90.94 2.68 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.838 0.855 . . . . 74.13 110.284 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -174.26 -58.59 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.168 0.587 . . . . 65.2 110.717 176.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.53 -72.32 0.03 OUTLIER Glycine 0 C--N 1.342 0.912 0 CA-C-N 115.695 -0.684 . . . . 72.01 111.528 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.42 ' HB2' ' HB3' ' A' ' 109' ' ' LEU . 25.0 mm-40 -99.74 167.1 10.77 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.182 0.515 . . . . 71.34 111.195 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 24.1 ptm -131.44 167.66 18.94 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.07 1.348 . . . . 72.13 108.672 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 90.2 mt -75.51 -66.69 0.74 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 122.738 0.415 . . . . 75.3 111.191 -173.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 N--CA 1.478 0.972 0 C-N-CA 123.264 0.626 . . . . 73.32 109.426 -172.018 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.3 m . . . . . 0 CA--C 1.546 0.794 0 N-CA-C 110.097 -0.334 . . . . 72.44 110.097 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 23.1 pttm -109.26 162.06 14.66 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.743 0.417 . . . . 75.34 110.712 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 79' ' ' ILE . 17.9 p -83.37 97.01 8.71 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.393 0.677 . . . . 74.24 109.555 175.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 56.9 mt -86.06 121.2 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.919 0.888 . . . . 74.03 110.58 -174.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -89.5 108.65 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 N-CA-C 109.591 -0.522 . . . . 74.23 109.591 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 60.7 mt -97.16 110.2 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.915 -0.772 . . . . 71.22 108.915 -176.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -93.74 151.93 19.29 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.288 0.635 . . . . 72.14 110.059 -175.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.436 ' HA ' HD11 ' A' ' 58' ' ' ILE . 9.1 p30 -66.36 -22.68 66.26 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.722 0.409 . . . . 71.4 111.483 178.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.4 p -83.35 -32.81 26.05 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.578 0.751 . . . . 72.05 110.726 176.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.4 75.06 9.84 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.816 0.846 . . . . 75.42 109.513 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -64.52 -28.58 69.75 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 114.625 -1.17 . . . . 74.43 113.588 -172.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -60.69 -38.29 84.5 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.584 0.629 . . . . 74.31 110.814 -179.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 78.5 mt -69.78 -38.5 76.73 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.421 0.688 . . . . 74.52 110.953 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.482 HG23 ' HG2' ' A' ' 65' ' ' GLN . 52.2 mt -62.65 -46.26 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.939 0.896 . . . . 74.11 110.246 175.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -58.86 -31.41 68.52 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.645 1.178 . . . . 63.23 111.692 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -70.36 -34.29 72.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.248 0.619 . . . . 74.41 111.463 177.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.2 t -113.17 105.04 12.97 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.479 0.712 . . . . 70.2 110.154 -175.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -56.98 -31.89 65.51 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.414 0.686 . . . . 72.4 110.748 174.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.465 HD11 HD12 ' A' ' 105' ' ' LEU . 43.9 tp -63.14 -44.52 95.31 Favored 'General case' 0 C--N 1.348 0.538 0 C-N-CA 124.095 0.958 . . . . 74.22 110.535 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.71 97.06 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 123.272 0.629 . . . . 71.02 110.698 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.482 ' HG2' HG23 ' A' ' 58' ' ' ILE . 68.9 mt-30 -56.93 -44.53 82.57 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 124.355 1.035 . . . . 71.24 110.846 177.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -68.32 -36.78 79.81 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.434 0.693 . . . . 73.01 111.987 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 81.3 mt -68.72 -48.67 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.28 0.632 . . . . 75.41 111.027 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -66.97 -30.6 70.77 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.693 0.397 . . . . 72.3 111.289 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.5 tp -72.37 -52.41 16.19 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.198 0.599 . . . . 75.32 111.291 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -85.02 -29.23 25.14 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.629 0.771 . . . . 75.35 111.937 -172.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 58.9 m -118.98 87.35 33.73 Favored Pre-proline 0 CA--C 1.544 0.749 0 N-CA-C 107.72 -1.215 . . . . 70.15 107.72 177.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.07 -17.77 45.78 Favored 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 123.11 2.54 . . . . 75.41 113.456 -172.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.5 -12.89 83.96 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-O 119.14 -0.811 . . . . 73.04 114.364 -177.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.4 t -70.64 123.32 24.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-N 117.491 0.646 . . . . 70.5 110.7 -175.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -81.22 -50.78 9.16 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.693 1.197 . . . . 74.22 110.168 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 56.7 p -157.62 163.65 38.05 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 114.637 -1.165 . . . . 72.34 110.911 -173.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.4 mt -119.27 164.94 14.9 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 124.761 1.224 . . . . 73.13 108.533 177.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.562 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 56.0 ttm -138.33 108.43 6.4 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 107.982 -1.118 . . . . 75.31 107.982 166.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.706 HD12 HD11 ' A' ' 84' ' ' LEU . 23.0 mm -83.81 102.05 9.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 108.465 -0.939 . . . . 70.24 108.465 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.38 -173.69 48.43 Favored Glycine 0 C--O 1.241 0.574 0 N-CA-C 110.511 -1.036 . . . . 74.23 110.511 173.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.74 -63.49 1.05 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.159 -0.682 . . . . 71.44 109.159 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -95.57 -21.59 18.16 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.025 0.53 . . . . 72.54 111.563 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -120.13 169.68 10.01 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.738 0.644 . . . . 74.34 112.738 -168.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.706 HD11 HD12 ' A' ' 79' ' ' ILE . 18.0 tp -142.79 117.64 9.92 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.164 1.386 . . . . 72.41 107.827 176.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.562 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 58.4 m -96.95 109.69 22.38 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.811 -0.811 . . . . 72.22 108.811 -177.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 25.8 mm -89.33 124.13 41.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.448 -0.945 . . . . 64.0 108.448 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -109.86 127.95 55.03 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.394 -1.336 . . . . 64.3 107.394 175.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.496 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -130.8 172.29 12.17 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.79 0.436 . . . . 74.32 110.093 -176.874 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -81.44 141.94 33.42 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 109.01 -0.737 . . . . 74.15 109.01 172.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -66.35 -10.88 47.44 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 113.581 0.956 . . . . 72.31 113.581 -172.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' MET . . . . . 0.413 ' HG3' HG22 ' A' ' 92' ' ' VAL . 24.1 ptm -76.04 -28.04 57.52 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.174 0.443 . . . . 73.42 111.144 175.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.413 HG22 ' HG3' ' A' ' 91' ' ' MET . 40.9 t -99.1 127.29 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 109.051 -0.722 . . . . 75.11 109.051 -175.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -95.3 154.12 17.35 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.35 0.66 . . . . 75.43 111.129 -173.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.496 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 97.2 m95 -68.04 -13.78 62.46 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.19 0.996 . . . . 73.31 112.598 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -52.5 -35.0 52.02 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.115 0.966 . . . . 75.1 111.876 175.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.4 t -97.26 -32.79 11.73 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.315 0.646 . . . . 74.14 110.826 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 65.1 mt -80.55 -51.27 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 123.509 0.724 . . . . 72.01 110.857 -166.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' A' ' 94' ' ' TRP . 59.8 mtpt -54.85 -58.45 14.46 Favored Pre-proline 0 N--CA 1.484 1.246 0 CA-C-O 117.583 -1.199 . . . . 74.31 113.064 -174.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -59.73 -36.25 92.24 Favored 'Trans proline' 0 C--N 1.398 3.135 0 C-N-CA 121.804 1.669 . . . . 62.34 112.203 -171.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 53.5 mt-10 -64.91 -46.43 81.74 Favored 'General case' 0 C--N 1.35 0.598 0 O-C-N 123.96 0.788 . . . . 71.34 110.272 177.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.33 -32.18 49.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 123.456 0.703 . . . . 75.21 111.888 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.448 HG12 ' O ' ' A' ' 98' ' ' LYS . 45.0 mm -62.99 -44.0 99.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 N-CA-C 109.165 -0.68 . . . . 72.23 109.165 175.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.56 -50.94 70.63 Favored 'General case' 0 C--N 1.354 0.783 0 CA-C-N 114.989 -1.005 . . . . 74.34 110.421 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 96.0 mt -61.85 -39.68 92.7 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.095 0.958 . . . . 72.34 111.567 -177.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.465 HD12 HD11 ' A' ' 63' ' ' LEU . 7.6 mp -64.73 -37.39 87.45 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.297 0.639 . . . . 74.13 110.812 176.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 85.4 m -71.8 -34.09 69.08 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.812 0.445 . . . . 75.23 109.978 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -67.41 -47.49 70.13 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 123.515 0.726 . . . . 75.42 109.994 176.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -48.24 81.29 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 124.22 0.95 . . . . 73.33 109.995 -175.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.42 ' HB3' ' HB2' ' A' ' 38' ' ' GLU . 67.3 mt -68.2 -14.24 62.83 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.916 0.76 . . . . 74.34 112.19 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -89.46 -22.15 22.63 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.542 0.737 . . . . 71.2 111.379 174.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -90.51 -51.98 5.13 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.229 0.538 . . . . 75.15 110.554 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -142.5 146.98 18.31 Favored Glycine 0 C--N 1.343 0.954 0 CA-C-N 114.974 -1.012 . . . . 62.35 111.835 -175.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -77.64 -34.58 53.14 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.591 0.756 . . . . 74.15 111.026 -174.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -97.7 138.82 34.5 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.002 0.521 . . . . 62.3 109.667 170.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 CA--C 1.543 0.693 0 C-N-CA 123.781 0.832 . . . . 74.34 111.304 -178.39 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.1 mt . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 121.028 0.442 . . . . 73.4 111.608 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -95.2 145.73 24.83 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.674 0.79 . . . . 73.13 109.018 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.0 mm -129.03 126.78 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 106.75 -1.574 . . . . 74.45 106.75 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -105.75 125.73 51.33 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.311 -0.996 . . . . 73.15 108.311 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.9 t -102.57 113.15 26.27 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 109.101 -0.704 . . . . 61.11 109.101 -177.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.8 mt -101.3 140.55 35.44 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.579 0.752 . . . . 71.51 110.321 177.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 28.0 p -85.34 157.69 20.47 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.005 0.522 . . . . 74.44 111.211 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.3 p -126.72 161.48 52.86 Favored Pre-proline 0 CA--C 1.558 1.283 0 C-N-CA 124.762 1.225 . . . . 71.44 108.305 -177.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -61.53 -17.92 56.74 Favored 'Trans proline' 0 C--N 1.383 2.364 0 C-N-CA 122.23 1.953 . . . . 62.04 113.526 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -101.29 132.41 46.83 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 108.684 -0.858 . . . . 72.41 108.684 175.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.09 -16.6 56.52 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.563 0.345 . . . . 61.14 111.918 -176.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -70.6 -38.75 74.04 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 109.41 -0.589 . . . . 72.12 109.41 175.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.48 144.62 26.63 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.499 0.72 . . . . 74.12 110.67 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.5 tp -154.94 124.29 6.38 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.211 -0.663 . . . . 74.01 109.211 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -83.63 121.37 27.16 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.766 0.826 . . . . 74.31 110.837 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -109.4 112.73 25.02 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.299 1.04 . . . . 74.42 108.468 168.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.2 tp -105.01 134.48 48.04 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.27 1.028 . . . . 72.55 109.352 -176.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.4 p -74.91 105.25 5.85 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 108.54 -0.911 . . . . 71.14 108.54 172.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.6 m -107.97 39.97 1.84 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.473 1.109 . . . . 74.21 110.025 -168.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -137.16 -156.14 0.67 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.043 -0.98 . . . . 63.14 108.548 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -72.87 -20.62 79.91 Favored Glycine 0 C--N 1.352 1.423 0 CA-C-N 118.295 0.498 . . . . 70.41 113.352 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -94.76 158.7 15.39 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 121.31 0.576 . . . . 74.34 111.633 -176.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.5 ttt -134.25 150.97 51.06 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.604 1.162 . . . . 74.15 109.128 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.542 ' O ' ' HB3' ' A' ' 114' ' ' ASP . 94.1 mt -78.77 -58.07 3.43 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.86 0.689 . . . . 74.41 112.86 -175.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 . . . . . 0 N--CA 1.48 1.07 0 O-C-N 121.591 -0.693 . . . . 72.34 109.731 -177.352 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.4 t . . . . . 0 CA--C 1.548 0.876 0 N-CA-C 109.822 -0.436 . . . . 74.12 109.822 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -93.35 142.59 27.15 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.073 0.949 . . . . 73.35 108.669 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.4 m -79.36 83.28 5.41 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 108.726 -0.842 . . . . 71.4 108.726 172.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 52.5 mt -73.93 99.58 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 CA-C-N 115.536 -0.756 . . . . 71.54 109.956 -170.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 77' ' ' LEU . 40.0 t -96.31 107.61 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 108.907 -0.775 . . . . 72.04 108.907 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.404 HG22 ' HB2' ' A' ' 57' ' ' LEU . 71.9 mt -105.18 113.46 42.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.436 1.094 . . . . 64.54 108.401 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.506 ' HZ2' ' HB2' ' A' ' 51' ' ' LYS . 10.6 mtmp? -80.2 161.53 25.15 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 108.862 -0.792 . . . . 73.02 108.862 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -64.09 -18.38 64.34 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.668 0.787 . . . . 74.31 111.935 178.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 74.1 p -74.9 -27.77 60.36 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.52 1.128 . . . . 73.51 112.08 175.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.89 69.35 10.55 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.792 0.837 . . . . 74.23 111.225 -172.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -60.12 -29.62 68.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.416 0.686 . . . . 74.23 111.609 -177.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -58.3 -48.46 80.44 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.684 1.194 . . . . 70.44 110.932 175.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.404 ' HB2' HG22 ' A' ' 50' ' ' ILE . 89.8 mt -79.05 -29.97 43.8 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 115.517 -0.765 . . . . 72.24 111.227 -177.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 93.5 mt -65.84 -43.48 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.874 0.869 . . . . 73.42 109.859 176.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.434 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 90.2 m-20 -69.96 -7.72 43.02 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.882 0.697 . . . . 62.52 112.882 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -91.89 -6.12 52.03 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 122.873 0.469 . . . . 73.54 110.946 174.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.3 p -140.2 104.78 4.89 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 123.748 0.819 . . . . 70.45 109.596 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 38.6 ttpt -56.69 -29.37 62.3 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.898 0.479 . . . . 74.11 111.461 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.512 ' HB2' ' NE2' ' A' ' 108' ' ' GLN . 25.5 tp -59.19 -46.62 87.95 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 123.292 0.637 . . . . 72.13 110.522 178.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.53 -47.16 86.61 Favored 'General case' 0 C--N 1.348 0.5 0 O-C-N 124.242 0.964 . . . . 73.24 110.375 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.434 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 97.6 mt-30 -54.4 -46.74 73.2 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.461 1.101 . . . . 75.55 111.57 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 15.0 mm100 -73.58 -35.26 65.42 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 116.043 -0.526 . . . . 74.32 112.027 -177.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 65.8 mt -65.45 -46.47 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 122.983 0.513 . . . . 74.42 110.319 177.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -70.08 -28.7 65.64 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.054 0.542 . . . . 75.24 111.71 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.5 tp -69.63 -55.99 8.52 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.727 0.411 . . . . 75.15 110.278 175.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -70.6 -26.81 63.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.367 -0.833 . . . . 63.21 110.949 -175.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.719 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 77.6 m -144.25 91.91 6.29 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 123.334 0.654 . . . . 54.44 109.932 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.58 3.01 5.18 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 122.97 2.447 . . . . 53.0 113.691 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -94.26 22.49 36.58 Favored Glycine 0 C--N 1.347 1.16 0 C-N-CA 122.82 0.248 . . . . 73.42 113.244 175.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 60.5 t -98.75 132.24 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.494 0.718 . . . . 72.53 109.707 172.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -88.61 -48.17 7.75 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.124 0.969 . . . . 73.13 112.602 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 53.9 p -159.25 163.24 36.02 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.859 0.464 . . . . 73.32 111.509 -177.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.416 ' O ' ' HA ' ' A' ' 49' ' ' VAL . 42.3 mt -124.88 125.59 44.21 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 107.983 -1.117 . . . . 63.12 107.983 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.488 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.9 ttm -105.47 112.68 25.86 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 107.657 -1.238 . . . . 70.3 107.657 174.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.461 HD13 HG21 ' A' ' 115' ' ' VAL . 18.9 mm -86.71 113.5 24.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.548 0 N-CA-C 107.956 -1.127 . . . . 74.44 107.956 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -84.12 -171.45 47.9 Favored Glycine 0 C--O 1.243 0.663 0 N-CA-C 111.373 -0.691 . . . . 65.14 111.373 174.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -70.12 -60.57 2.21 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.381 -0.599 . . . . 74.43 109.381 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -96.67 -37.09 10.47 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.587 1.155 . . . . 74.33 109.989 178.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -102.92 175.87 5.34 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.512 -1.222 . . . . 75.11 112.529 -165.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.407 HD22 HD12 ' A' ' 86' ' ' ILE . 29.2 tp -129.57 146.6 51.37 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 106.69 -1.596 . . . . 74.43 106.69 173.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.488 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 89.9 m -130.01 110.1 11.38 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.476 -0.935 . . . . 61.13 108.476 174.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.526 HG13 HD11 ' A' ' 101' ' ' ILE . 22.5 mm -88.56 118.18 33.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 108.653 -0.869 . . . . 72.35 108.653 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -96.28 116.92 29.79 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 107.9 -1.148 . . . . 74.51 107.9 172.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 19.5 pttp -104.58 175.02 5.63 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.527 0.731 . . . . 71.54 109.354 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -74.74 137.52 42.09 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.154 -0.93 . . . . 75.3 108.732 168.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -36.38 74.53 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.21 1.404 . . . . 74.34 113.002 -176.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 66.3 mtt -83.83 -15.17 49.28 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.565 0.746 . . . . 71.55 111.431 -177.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.9 t -88.33 144.76 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 109.323 -0.621 . . . . 74.22 109.323 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -105.11 144.56 31.74 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.101 0.961 . . . . 74.14 110.556 -171.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 53.1 m95 -66.98 -23.79 65.98 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 114.069 1.137 . . . . 73.11 114.069 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -61.48 -21.34 64.1 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.123 0.569 . . . . 75.34 112.0 -172.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -92.88 -33.78 14.08 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.393 0.677 . . . . 71.11 111.71 174.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.719 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 34.6 mt -83.44 -47.29 18.21 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 C-N-CA 123.245 0.618 . . . . 74.31 111.315 -166.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -53.83 -53.23 60.13 Favored Pre-proline 0 N--CA 1.486 1.355 0 CA-C-O 117.651 -1.166 . . . . 75.13 114.015 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -56.87 -37.93 97.07 Favored 'Trans proline' 0 C--N 1.399 3.231 0 C-N-CA 122.142 1.895 . . . . 73.15 111.701 -176.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -61.45 -53.78 52.09 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.033 -0.985 . . . . 73.33 110.396 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.526 HD11 HG13 ' A' ' 86' ' ' ILE . 65.0 mt -61.42 -51.94 67.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.904 0 O-C-N 124.132 0.895 . . . . 75.21 111.917 -178.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 98.0 mt -56.45 -43.61 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 123.757 0.823 . . . . 74.22 111.483 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.25 -48.99 79.57 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.906 0.754 . . . . 64.12 110.067 177.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.3 mt -58.39 -44.54 88.97 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 114.656 -1.157 . . . . 73.11 112.087 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.5 HD12 HD11 ' A' ' 63' ' ' LEU . 10.2 mp -65.84 -33.66 76.35 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.571 0.748 . . . . 74.33 111.755 -178.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 60.9 m -75.84 -34.68 60.08 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.219 0.608 . . . . 71.22 110.383 -176.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -75.19 -48.55 23.02 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.077 0.551 . . . . 73.44 110.177 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.512 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 23.6 tt0 -51.18 -59.9 3.69 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 125.586 1.554 . . . . 75.35 112.483 -176.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.4 mt -63.41 -26.88 68.94 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.761 -1.108 . . . . 74.32 110.97 -177.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.98 -10.12 59.35 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.917 0.887 . . . . 74.52 112.268 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -81.46 -15.18 55.81 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 122.61 0.364 . . . . 72.21 110.764 169.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 113.88 -28.7 8.27 Favored Glycine 0 C--N 1.346 1.119 0 CA-C-N 116.135 -0.484 . . . . 71.34 112.101 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -90.42 178.67 6.06 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.621 0.769 . . . . 73.53 112.724 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.542 ' HB3' ' O ' ' A' ' 40' ' ' LEU . 6.2 m-20 -110.23 -170.64 1.68 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.424 -1.262 . . . . 54.33 111.453 -170.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.464 ' HA ' ' NE2' ' A' ' 108' ' ' GLN . 7.2 p . . . . . 0 N--CA 1.48 1.045 0 C-N-CA 124.316 1.047 . . . . 71.21 112.196 178.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.3 mm . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 109.161 -0.681 . . . . 75.12 109.161 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 59.2 m80 -74.04 116.01 14.18 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.484 1.114 . . . . 60.32 110.196 -177.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.8 mm -122.98 114.46 42.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.827 0 N-CA-C 107.697 -1.223 . . . . 65.02 107.697 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 40.7 ttmt -98.94 131.35 45.07 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.473 0.709 . . . . 73.51 109.992 -177.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.7 m -93.55 114.01 26.26 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.969 -0.752 . . . . 74.45 108.969 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.3 mt -121.14 137.61 54.59 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.859 0.864 . . . . 72.4 110.141 -175.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.2 p -85.73 153.83 22.05 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.876 0.87 . . . . 71.3 111.09 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.406 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 47.7 p -121.51 175.67 2.35 Favored Pre-proline 0 CA--C 1.56 1.35 0 N-CA-C 107.715 -1.217 . . . . 75.21 107.715 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . 0.406 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 62.6 Cg_endo -71.76 2.76 4.36 Favored 'Trans proline' 0 C--N 1.377 2.057 0 C-N-CA 121.886 1.724 . . . . 72.54 113.061 167.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.511 ' HB2' ' HB1' ' A' ' 29' ' ' ALA . 91.2 m-20 -108.3 135.7 49.17 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.212 1.005 . . . . 75.11 111.501 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -72.02 -25.37 61.79 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.207 1.003 . . . . 75.31 111.623 174.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.445 ' O ' ' HA ' ' A' ' 87' ' ' ASN . 86.7 m-20 -112.02 29.94 7.46 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.021 0.928 . . . . 71.22 110.553 -176.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.511 ' HB1' ' HB2' ' A' ' 26' ' ' ASN . . . -142.01 124.73 15.95 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.177 0.591 . . . . 74.12 109.634 172.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.1 tp -135.02 121.43 20.42 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 108.609 -0.885 . . . . 74.52 108.609 178.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.504 ' HE2' HD11 ' A' ' 33' ' ' LEU . 87.8 tttt -87.61 119.43 27.91 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.181 0.992 . . . . 72.33 111.116 -175.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -103.8 111.21 23.63 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 107.818 -1.178 . . . . 73.32 107.818 173.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.504 HD11 ' HE2' ' A' ' 31' ' ' LYS . 37.8 tp -104.35 128.16 52.13 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 124.382 1.073 . . . . 74.12 110.185 -167.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 28.4 m -70.76 105.69 3.29 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.753 -1.202 . . . . 73.4 107.753 170.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.0 m -86.87 -15.53 38.78 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.858 0.463 . . . . 72.14 111.754 -168.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.58 -64.3 1.1 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.531 0.733 . . . . 75.33 111.201 -178.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 39' ' ' MET . . . 156.08 -7.4 0.25 Allowed Glycine 0 C--N 1.341 0.847 0 CA-C-O 119.392 -0.671 . . . . 74.33 113.302 -174.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.472 ' HB3' ' HB3' ' A' ' 109' ' ' LEU . 1.0 OUTLIER -71.07 104.72 3.11 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 108.158 -1.053 . . . . 73.31 108.158 168.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.581 ' HE1' ' HB3' ' A' ' 82' ' ' ASP . 87.9 mtp -103.3 151.04 23.17 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.652 0.781 . . . . 74.42 110.605 -170.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.7 mt -71.4 -36.4 71.37 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.885 0.874 . . . . 63.23 112.008 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 . . . . . 0 N--CA 1.485 1.325 0 C-N-CA 123.515 0.726 . . . . 75.12 109.644 -179.706 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 41.4 t . . . . . 0 N--CA 1.473 0.716 0 CA-C-O 120.88 0.371 . . . . 72.4 111.0 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -70.35 158.25 36.28 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 115.16 -0.927 . . . . 74.33 110.52 173.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.3 m -78.67 89.15 4.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.372 0.669 . . . . 74.04 109.431 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.61 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 42.8 mt -77.21 100.42 2.71 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 108.852 -0.795 . . . . 75.24 108.852 -177.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.1 t -90.33 109.8 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.549 0.74 . . . . 74.23 109.267 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 81.4 mt -118.73 111.06 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.39 1.076 . . . . 75.34 108.575 -178.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.495 ' HG2' ' HB3' ' A' ' 76' ' ' SER . 94.9 mttt -88.03 159.36 18.3 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 109.666 -0.494 . . . . 74.24 109.666 176.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -64.83 -20.93 66.66 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.918 0.487 . . . . 73.53 110.934 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 22.9 p -78.61 -31.23 46.96 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.124 0.97 . . . . 70.2 110.985 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -76.48 74.31 3.22 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.584 0.754 . . . . 74.45 110.128 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -55.88 -43.53 77.26 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.926 0.89 . . . . 65.31 111.742 -175.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -55.59 -48.31 75.05 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.09 0.956 . . . . 75.15 110.907 -177.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.3 mt -62.39 -36.05 81.09 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.102 -0.954 . . . . 72.2 111.052 -178.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 54.0 mt -73.51 -45.27 52.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 123.183 0.593 . . . . 71.3 110.311 -177.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -54.12 -30.87 50.49 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.422 1.089 . . . . 73.5 111.791 -178.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 64.1 m80 -87.81 -44.66 10.95 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.666 0.787 . . . . 71.13 110.703 175.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.5 m -79.04 98.76 6.6 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.056 0.455 . . . . 73.4 111.376 -176.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.417 ' HE3' HE22 ' A' ' 108' ' ' GLN . 31.6 ttpt -46.55 -53.08 12.07 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.716 1.607 . . . . 73.42 113.63 178.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.443 ' HB3' HG21 ' A' ' 115' ' ' VAL . 30.5 tp -65.3 -34.85 79.31 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.976 0.51 . . . . 75.35 111.722 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.15 -40.95 97.7 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 122.329 0.252 . . . . 75.01 110.527 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -56.07 -50.34 71.27 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.013 0.821 . . . . 75.42 110.305 176.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -60.83 -48.81 80.09 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.059 0.943 . . . . 74.01 113.127 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.3 -51.16 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 C-N-CA 123.403 0.681 . . . . 74.03 111.293 -175.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -67.23 -33.63 75.75 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.046 0.538 . . . . 75.23 111.193 -179.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.6 tp -59.81 -53.69 54.93 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.499 0.72 . . . . 74.04 110.794 176.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.493 ' NE2' HD21 ' A' ' 104' ' ' LEU . 74.1 mt-30 -77.45 -24.55 50.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 114.978 -1.01 . . . . 74.32 112.498 -175.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.55 ' SG ' HG21 ' A' ' 97' ' ' ILE . 72.7 m -144.84 96.91 4.99 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 109.35 -0.611 . . . . 72.11 109.35 -178.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.4 0.27 10.08 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 122.827 2.352 . . . . 73.12 113.132 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -84.68 -0.54 89.22 Favored Glycine 0 C--N 1.353 1.503 0 CA-C-O 119.89 -0.394 . . . . 74.23 113.023 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.0 t -82.22 123.76 38.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.237 0.615 . . . . 71.31 109.599 176.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -77.79 -55.0 5.69 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.932 0.893 . . . . 75.41 110.601 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.495 ' HB3' ' HG2' ' A' ' 51' ' ' LYS . 27.7 p -150.14 164.03 36.67 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.577 0.703 . . . . 74.41 111.459 -175.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 78.6 mt -122.57 128.66 51.02 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.427 1.091 . . . . 75.11 108.265 178.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.514 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.4 ttm -102.25 99.12 9.19 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 106.741 -1.577 . . . . 75.41 106.741 169.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.61 ' HB ' ' HB ' ' A' ' 48' ' ' ILE . 29.1 mm -80.87 125.22 39.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.24 -1.022 . . . . 75.53 108.24 -177.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.52 -173.18 20.8 Favored Glycine 0 C--O 1.242 0.6 0 N-CA-C 111.539 -0.625 . . . . 74.41 111.539 172.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -80.06 -58.18 3.28 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 122.807 0.443 . . . . 71.24 110.453 176.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.581 ' HB3' ' HE1' ' A' ' 39' ' ' MET . 8.4 p-10 -113.79 18.51 17.35 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 122.877 0.471 . . . . 71.41 110.92 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -148.5 163.61 36.66 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 122.755 0.422 . . . . 73.53 110.944 -177.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 51.8 tp -144.94 107.05 4.32 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.472 0.709 . . . . 74.22 109.243 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.514 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 28.0 m -96.95 106.74 19.13 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.299 -1.0 . . . . 75.13 108.299 -179.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.568 HG13 HD12 ' A' ' 101' ' ' ILE . 21.8 mm -87.47 141.53 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.518 0.727 . . . . 75.02 109.291 -175.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.445 ' HA ' ' O ' ' A' ' 28' ' ' ASN . 24.2 m-80 -120.82 120.63 36.13 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.802 0.841 . . . . 74.51 109.06 176.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.01 165.94 15.25 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.719 0.808 . . . . 75.42 110.191 179.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -68.0 141.45 56.24 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.696 0.798 . . . . 62.3 109.382 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -68.63 -10.98 59.43 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 112.855 0.687 . . . . 75.52 112.855 -171.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.3 ptp -77.95 -16.13 58.42 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.011 0.525 . . . . 75.31 111.133 174.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.522 HG11 HD11 ' A' ' 97' ' ' ILE . 34.4 t -93.54 141.98 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.148 0.979 . . . . 75.25 110.262 -176.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . 0.479 ' HD2' ' H ' ' A' ' 95' ' ' ASN . 4.8 t60 -95.17 136.23 35.77 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.922 0.889 . . . . 70.32 108.881 176.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 44.9 m95 -58.66 -43.55 89.89 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.611 0.967 . . . . 74.51 113.611 -174.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . 0.479 ' H ' ' HD2' ' A' ' 93' ' ' HIS . 9.8 t30 -57.82 -18.58 22.96 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.469 0.707 . . . . 70.22 112.717 -174.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.4 m -69.21 -54.27 15.63 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 121.386 0.613 . . . . 73.1 110.628 174.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.55 HG21 ' SG ' ' A' ' 71' ' ' CYS . 16.4 mt -83.96 -32.97 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 123.913 0.885 . . . . 75.3 110.858 -171.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -50.35 -56.08 20.95 Favored Pre-proline 0 CA--C 1.567 1.611 0 C-N-CA 125.038 1.335 . . . . 72.41 114.219 -172.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.58 -27.59 38.82 Favored 'Trans proline' 0 C--N 1.393 2.869 0 C-N-CA 121.8 1.666 . . . . 62.22 111.961 -176.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -67.78 -43.38 79.92 Favored 'General case' 0 C--N 1.349 0.568 0 C-N-CA 123.517 0.727 . . . . 75.23 109.746 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.568 HD12 HG13 ' A' ' 86' ' ' ILE . 95.6 mt -60.01 -51.16 76.15 Favored 'Isoleucine or valine' 0 C--N 1.359 0.998 0 C-N-CA 123.865 0.866 . . . . 72.13 109.784 176.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 74.0 mt -56.47 -41.04 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.522 0.729 . . . . 74.43 110.797 -178.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.75 -46.8 77.47 Favored 'General case' 0 CA--C 1.549 0.939 0 O-C-N 123.694 0.621 . . . . 55.11 110.933 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.493 HD21 ' NE2' ' A' ' 70' ' ' GLN . 99.0 mt -63.97 -35.07 79.48 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.958 0.903 . . . . 71.42 111.852 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -72.93 -23.72 60.72 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.83 0.852 . . . . 64.14 110.793 177.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 64.3 m -77.41 -36.59 53.17 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 109.183 -0.673 . . . . 75.02 109.183 174.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.53 ' HZ1' ' HE2' ' A' ' 111' ' ' TYR . 1.5 mmmp? -66.42 -39.29 88.88 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.341 0.656 . . . . 73.01 110.296 175.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.417 HE22 ' HE3' ' A' ' 62' ' ' LYS . 11.7 mm100 -60.19 -63.68 1.22 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.561 0.745 . . . . 73.45 110.714 176.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.472 ' HB3' ' HB3' ' A' ' 38' ' ' GLU . 74.2 mt -78.55 -2.83 40.7 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 114.854 -1.066 . . . . 74.23 112.377 -167.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -89.71 -49.03 6.88 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.531 0.732 . . . . 73.35 111.266 171.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.53 ' HE2' ' HZ1' ' A' ' 107' ' ' LYS . 14.5 m-85 -88.88 -52.35 5.15 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 116.129 -0.487 . . . . 72.14 110.78 -171.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -158.67 103.57 0.23 Allowed Glycine 0 C--N 1.342 0.884 0 N-CA-C 109.867 -1.293 . . . . 62.13 109.867 -175.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.99 -24.95 64.87 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.908 1.283 . . . . 72.51 112.778 -164.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -68.05 118.28 11.01 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 123.688 0.618 . . . . 73.34 109.96 -176.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.466 HG11 HG23 ' A' ' 79' ' ' ILE . 3.5 p . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 125.625 1.57 . . . . 75.41 112.74 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.421 ' HB ' HG23 ' A' ' 106' ' ' THR . 77.0 mt . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 108.067 -1.086 . . . . 73.25 108.067 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.463 ' HB3' ' HB3' ' A' ' 36' ' ' ASP . 62.7 t60 -69.23 122.14 18.23 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 113.829 -1.532 . . . . 73.41 111.707 -170.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 47.9 mm -126.34 125.55 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 107.239 -1.393 . . . . 71.22 107.239 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -99.13 126.13 44.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.069 0.548 . . . . 74.23 109.541 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 35.0 m -92.0 117.21 29.6 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.276 0.63 . . . . 73.43 109.382 -177.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.6 mt -115.11 138.47 50.86 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.179 0.991 . . . . 75.34 109.407 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 54.9 p -85.13 153.27 22.79 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.297 0.639 . . . . 73.12 110.568 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.7 p -119.52 172.73 4.14 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 124.291 1.037 . . . . 75.34 109.064 -174.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -75.17 14.86 0.83 Allowed 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 122.185 1.923 . . . . 74.15 113.215 167.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.4 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 11.1 m120 -118.95 157.16 28.26 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 124.167 0.987 . . . . 71.44 109.361 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.76 -32.93 10.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.276 0.631 . . . . 73.35 109.931 175.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -71.6 -40.63 69.71 Favored 'General case' 0 C--O 1.215 -0.759 0 C-N-CA 123.0 0.52 . . . . 74.52 110.153 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.4 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -93.09 141.22 28.66 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.075 0.55 . . . . 62.35 111.487 -175.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.8 tp -140.49 133.2 28.9 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 108.455 -0.943 . . . . 73.0 108.455 172.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -93.25 131.52 38.29 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.824 0.85 . . . . 73.34 110.672 -173.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -120.17 121.02 37.84 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.826 1.25 . . . . 75.11 107.996 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.3 tp -106.77 128.8 54.54 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.567 0.747 . . . . 73.51 110.488 -171.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.2 m -73.91 106.09 5.46 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.319 -0.993 . . . . 73.11 108.319 171.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.4 m -105.85 -32.19 8.48 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.024 0.53 . . . . 71.42 111.797 -163.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.463 ' HB3' ' HB3' ' A' ' 18' ' ' HIS . 5.8 p-10 -82.55 -162.55 0.59 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.273 0.229 . . . . 53.11 110.593 178.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.69 -16.67 63.8 Favored Glycine 0 C--N 1.355 1.589 0 N-CA-C 114.323 0.489 . . . . 54.51 114.323 -177.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -86.21 147.31 26.17 Favored 'General case' 0 C--N 1.352 0.688 0 CA-C-N 117.82 0.81 . . . . 73.01 110.266 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.491 ' HE3' ' HB3' ' A' ' 82' ' ' ASP . 25.4 ttt -147.05 130.64 16.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 107.638 -1.245 . . . . 70.53 107.638 -173.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 114' ' ' ASP . 64.1 mt -54.15 -45.94 72.14 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.87 0.868 . . . . 73.14 112.176 -171.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.549 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 5.4 tt0 . . . . . 0 CA--C 1.544 0.72 0 C-N-CA 125.117 1.367 . . . . 73.12 108.757 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 0 N--CA 1.476 0.874 0 CA-C-O 120.991 0.424 . . . . 71.04 110.839 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -97.36 -174.37 2.91 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.845 1.258 . . . . 74.44 110.925 -174.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 28.0 p -76.82 88.02 3.42 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.235 0.614 . . . . 73.14 110.1 175.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.7 mt -76.8 127.61 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.803 0.841 . . . . 74.25 110.828 -177.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 95.6 t -89.79 123.81 42.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 N-CA-C 109.127 -0.694 . . . . 74.25 109.127 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.447 HG12 ' HB3' ' A' ' 57' ' ' LEU . 54.5 mt -116.02 110.11 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 108.283 -1.006 . . . . 73.15 108.283 174.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -90.87 164.79 13.92 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 109.203 -0.666 . . . . 75.41 109.203 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -57.44 -27.35 62.36 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 124.168 0.918 . . . . 74.04 112.292 175.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.5 p -75.31 -33.76 61.2 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.64 0.776 . . . . 73.51 111.86 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.417 ' O ' HG13 ' A' ' 58' ' ' ILE . 3.9 m-20 -78.86 74.23 5.39 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.431 0.692 . . . . 72.11 111.164 -170.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -50.49 -42.38 54.6 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.977 1.311 . . . . 73.04 111.565 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -58.37 -49.25 77.91 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.752 0.821 . . . . 75.23 111.476 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.447 ' HB3' HG12 ' A' ' 50' ' ' ILE . 80.4 mt -70.49 -38.82 74.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.538 0.735 . . . . 63.45 111.362 -175.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 54' ' ' ASP . 81.4 mt -57.76 -48.13 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.02 0.928 . . . . 75.44 109.443 175.078 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.402 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 89.5 m-20 -66.64 -26.05 66.88 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.355 0.872 . . . . 62.31 113.355 -179.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -70.52 -36.57 73.83 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.536 0.334 . . . . 74.42 111.383 178.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.5 p -116.62 105.72 12.75 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.518 0.727 . . . . 72.42 109.552 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -62.77 -19.94 64.48 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.993 0.517 . . . . 74.02 111.427 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.552 HD13 HD12 ' A' ' 105' ' ' LEU . 48.7 tp -60.04 -46.98 87.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.366 0.666 . . . . 72.24 110.1 170.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.13 -41.81 99.38 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.242 0.617 . . . . 64.23 110.745 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.402 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 99.4 mt-30 -56.4 -48.6 76.59 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 123.861 0.726 . . . . 74.32 110.883 175.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -60.51 -44.56 95.88 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.86 0.864 . . . . 63.32 112.79 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.49 HG22 HG23 ' A' ' 74' ' ' VAL . 97.1 mt -66.54 -46.41 86.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 123.35 0.66 . . . . 75.1 110.605 -177.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -68.95 -37.07 78.63 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.799 0.44 . . . . 75.34 111.779 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.2 tp -66.82 -53.83 28.73 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.526 0.73 . . . . 73.3 110.604 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -81.0 -24.05 38.25 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 114.941 -1.027 . . . . 72.31 111.666 -173.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 38.2 m -126.37 97.15 34.72 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 109.487 -0.56 . . . . 75.03 109.487 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.11 -17.34 45.59 Favored 'Trans proline' 0 C--N 1.378 2.093 0 C-N-CA 123.59 2.86 . . . . 64.25 113.879 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -89.96 13.59 64.21 Favored Glycine 0 C--N 1.346 1.11 0 CA-C-O 119.69 -0.505 . . . . 73.01 113.576 -177.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.49 HG23 HG22 ' A' ' 67' ' ' ILE . 41.6 t -85.69 122.4 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.732 -0.84 . . . . 72.02 108.732 173.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -90.06 -40.49 12.26 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.509 0.724 . . . . 74.03 110.085 -177.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.9 p -160.1 170.85 20.38 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.486 -0.779 . . . . 72.4 110.832 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 85.4 mt -131.61 150.52 52.12 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.045 1.338 . . . . 72.04 108.516 177.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.416 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 57.6 ttm -123.85 102.56 7.86 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 107.255 -1.387 . . . . 75.22 107.255 167.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 15.3 mm -82.5 120.45 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 115.552 -0.749 . . . . 73.54 109.176 -177.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.06 -179.7 21.28 Favored Glycine 0 C--O 1.242 0.642 0 N-CA-C 111.41 -0.676 . . . . 73.01 111.41 172.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.549 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 4.5 p-10 -72.33 -53.8 11.32 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.294 0.638 . . . . 74.5 110.774 178.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.491 ' HB3' ' HE3' ' A' ' 39' ' ' MET . 14.0 p-10 -116.58 -0.3 12.47 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.755 -0.591 . . . . 73.55 111.435 177.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -126.52 156.24 41.09 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.754 -0.462 . . . . 75.22 109.754 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.527 HD21 HD13 ' A' ' 105' ' ' LEU . 39.5 tp -144.84 119.69 9.92 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.216 -0.661 . . . . 74.32 109.216 176.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.416 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 32.9 m -107.59 108.35 19.59 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 109.415 -0.587 . . . . 75.3 109.415 -177.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.502 ' HB ' ' HH2' ' A' ' 94' ' ' TRP . 21.1 mm -89.66 141.48 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 N-CA-C 108.259 -1.015 . . . . 74.34 108.259 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -114.31 119.67 37.76 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.601 -0.518 . . . . 75.01 109.601 179.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.556 ' HZ2' HD13 ' A' ' 97' ' ' ILE . 5.0 mptp? -105.45 159.31 16.03 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.684 1.194 . . . . 72.52 110.734 177.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -69.49 145.46 52.69 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 114.187 -1.369 . . . . 73.41 109.254 172.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -25.69 68.42 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 123.886 0.874 . . . . 75.2 113.093 -176.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 65.6 mtm -87.58 -9.01 55.55 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.672 0.789 . . . . 74.54 111.276 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 39.8 t -102.53 135.98 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 109.528 -0.545 . . . . 71.44 109.528 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -79.64 138.17 37.32 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.233 1.013 . . . . 61.01 111.387 -172.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.502 ' HH2' ' HB ' ' A' ' 86' ' ' ILE . 6.0 m95 -80.38 -52.8 7.25 Favored 'General case' 0 N--CA 1.483 1.217 0 N-CA-C 113.277 0.844 . . . . 73.22 113.277 -174.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.87 -18.16 54.52 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.782 0.833 . . . . 63.41 112.843 -174.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.1 t -74.67 -40.77 61.21 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.168 0.987 . . . . 73.43 110.267 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.556 HD13 ' HZ2' ' A' ' 88' ' ' LYS . 16.2 mt -94.12 -15.54 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 CA-C-N 115.162 -0.926 . . . . 74.11 112.552 -168.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -49.63 -47.89 77.64 Favored Pre-proline 0 N--CA 1.491 1.579 0 CA-C-O 118.193 -0.908 . . . . 72.25 113.114 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -56.36 -39.12 93.39 Favored 'Trans proline' 0 C--N 1.396 3.073 0 C-N-CA 122.012 1.808 . . . . 62.15 113.126 176.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.451 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 8.3 mm-40 -63.61 -50.95 67.36 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.344 0.658 . . . . 74.11 110.403 -178.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.418 ' O ' HD11 ' A' ' 105' ' ' LEU . 76.4 mt -61.17 -54.84 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.017 -0.992 . . . . 74.24 110.489 -177.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 89.1 mt -55.37 -38.28 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 123.511 0.724 . . . . 74.23 110.96 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -66.17 -43.69 86.19 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.493 0.717 . . . . 74.34 111.112 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 88.9 mt -64.35 -38.57 91.52 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.463 0.705 . . . . 74.23 111.194 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.552 HD12 HD13 ' A' ' 63' ' ' LEU . 10.0 mp -63.52 -34.45 77.81 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.645 0.778 . . . . 75.23 110.277 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.421 HG23 ' HB ' ' A' ' 17' ' ' ILE . 93.1 m -72.96 -31.32 64.48 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.302 0.641 . . . . 74.0 110.102 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -63.86 -54.42 35.22 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.9 0.48 . . . . 75.54 110.35 176.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -58.27 -45.05 88.58 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 123.824 0.703 . . . . 73.44 111.541 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 40' ' ' LEU . 95.8 mt -75.93 -17.83 59.6 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.091 -0.959 . . . . 74.51 111.434 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.34 -28.8 59.75 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.143 0.577 . . . . 63.22 110.418 172.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -72.31 -27.09 62.23 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.148 -0.478 . . . . 74.25 109.921 168.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.67 30.38 64.12 Favored Glycine 0 C--N 1.353 1.516 0 CA-C-N 115.513 -0.767 . . . . 65.33 111.213 -172.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -92.91 139.96 29.98 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.441 1.096 . . . . 74.34 111.151 -171.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.426 ' HA ' ' O ' ' A' ' 40' ' ' LEU . 5.8 m-20 -76.65 119.11 20.01 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.474 -0.936 . . . . 74.52 108.474 169.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 2.7 p . . . . . 0 CA--C 1.553 1.074 0 C-N-CA 125.636 1.574 . . . . 71.23 112.385 -176.22 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.8 mt . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 109.808 -0.441 . . . . 74.24 109.808 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -72.31 122.24 20.81 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.421 -0.809 . . . . 74.2 109.564 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.8 mm -115.55 122.22 68.91 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 105.599 -2.0 . . . . 72.31 105.599 177.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -91.01 120.59 32.13 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.308 -0.997 . . . . 74.25 108.308 -172.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.7 m -93.25 113.29 25.46 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.522 -0.918 . . . . 63.52 108.522 -176.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.9 mt -105.83 138.14 42.53 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.601 0.76 . . . . 65.21 109.388 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.0 p -73.71 142.63 46.34 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.708 0.803 . . . . 71.42 110.695 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 p -113.09 168.0 8.4 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 124.681 1.192 . . . . 71.03 109.827 -174.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -67.73 -10.87 30.21 Favored 'Trans proline' 0 C--N 1.383 2.388 0 C-N-CA 122.693 2.262 . . . . 71.42 113.459 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -125.12 134.52 52.42 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.456 0.702 . . . . 71.44 109.761 -178.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -73.2 -24.85 60.57 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.279 0.632 . . . . 71.24 110.973 173.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -66.08 -20.75 66.26 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.115 0.966 . . . . 74.2 111.218 176.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.1 162.56 22.22 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.24 1.016 . . . . 74.41 110.107 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.4 tp -160.66 131.24 5.36 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 109.571 -0.529 . . . . 73.31 109.571 173.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -85.44 117.11 24.16 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.281 1.032 . . . . 74.21 110.85 -174.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -107.77 110.8 22.7 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.399 1.079 . . . . 73.44 108.216 173.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.6 tp -102.84 123.61 46.81 Favored 'General case' 0 C--O 1.243 0.744 0 N-CA-C 108.674 -0.861 . . . . 61.22 108.674 -169.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.1 p -80.87 106.21 12.7 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 107.828 -1.175 . . . . 75.2 107.828 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.2 p -109.89 -58.52 2.05 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.765 0.826 . . . . 74.43 110.181 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -69.72 110.29 4.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.135 0.974 . . . . 72.32 111.607 -172.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.08 -85.23 1.01 Allowed Glycine 0 C--N 1.342 0.911 0 O-C-N 124.107 0.879 . . . . 74.2 112.989 174.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.8 mp0 -95.62 164.14 12.9 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.9 0.88 . . . . 74.24 111.993 -170.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.3 ttt -125.58 147.28 49.34 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.077 1.751 . . . . 72.13 107.554 -177.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.7 mt -67.35 -51.97 45.84 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.085 0.772 . . . . 72.51 113.085 -169.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.622 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.1 tt0 . . . . . 0 N--CA 1.478 0.938 0 C-N-CA 123.239 0.616 . . . . 72.51 109.55 -172.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.5 p . . . . . 0 CA--C 1.541 0.605 0 N-CA-C 110.04 -0.356 . . . . 73.41 110.04 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -98.26 162.49 13.16 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.635 0.774 . . . . 75.14 110.067 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 p -82.82 99.5 9.74 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.615 0.766 . . . . 74.03 109.774 176.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.0 mt -76.87 107.73 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 123.142 0.577 . . . . 73.4 110.377 -173.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 76.8 t -87.55 105.34 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 108.046 -1.094 . . . . 74.24 108.046 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.492 HD12 ' HG ' ' A' ' 61' ' ' SER . 75.2 mt -94.83 109.09 21.73 Favored 'Isoleucine or valine' 0 C--N 1.337 0.062 0 N-CA-C 107.999 -1.112 . . . . 75.13 107.999 -178.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -87.64 142.22 28.01 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.679 0.792 . . . . 74.41 109.77 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.466 ' HA ' HD11 ' A' ' 58' ' ' ILE . 36.9 p30 -67.43 -22.45 65.51 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.245 0.618 . . . . 74.35 111.574 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.2 t -87.85 -4.79 58.83 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.95 0.9 . . . . 71.42 112.043 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -108.11 103.7 12.97 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.102 0.561 . . . . 62.34 110.186 -175.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -45.44 -61.97 1.46 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 124.932 1.293 . . . . 55.3 113.605 176.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -69.65 -30.95 68.76 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.758 0.651 . . . . 73.01 112.758 -166.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.17 -36.17 83.18 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 123.397 0.436 . . . . 73.32 111.666 175.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.466 HD11 ' HA ' ' A' ' 52' ' ' ASN . 39.6 mt -84.22 -38.17 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 123.309 0.644 . . . . 71.11 110.381 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -56.19 -39.85 73.06 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 125.061 1.344 . . . . 64.52 112.15 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -85.98 -1.98 57.85 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.798 -0.637 . . . . 74.23 111.566 -176.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.492 ' HG ' HD12 ' A' ' 50' ' ' ILE . 34.0 p -127.78 101.38 6.33 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.208 0.603 . . . . 73.22 111.135 -172.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -57.65 -47.28 82.72 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.473 1.109 . . . . 74.32 112.287 -177.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.5 tp -63.93 -35.99 82.47 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 123.912 0.758 . . . . 74.31 111.409 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.39 -40.94 89.96 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.668 0.387 . . . . 72.11 111.189 178.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -58.79 -43.5 90.5 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 124.241 0.963 . . . . 74.05 110.242 176.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -58.66 -51.45 69.88 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.644 0.778 . . . . 75.14 112.519 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 83.3 mt -66.18 -44.54 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.434 0.694 . . . . 73.35 111.35 -173.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -71.13 -37.69 72.3 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 112.243 0.46 . . . . 74.51 112.243 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 42.9 tp -69.87 -45.92 66.65 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.865 0.466 . . . . 74.54 110.919 -177.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -81.08 -29.88 34.84 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.222 0.609 . . . . 74.53 111.691 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 63.9 m -133.28 88.11 36.5 Favored Pre-proline 0 CA--C 1.548 0.904 0 N-CA-C 109.057 -0.72 . . . . 74.14 109.057 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -77.02 -2.32 12.56 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 122.735 2.29 . . . . 75.44 112.758 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.04 3.4 71.13 Favored Glycine 0 C--N 1.356 1.659 0 CA-C-N 116.327 -0.397 . . . . 71.43 113.18 176.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.0 t -92.68 133.3 34.42 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.405 1.082 . . . . 74.41 109.974 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.43 ' H ' ' HA ' ' A' ' 88' ' ' LYS . 16.2 mm-40 -86.16 -49.95 7.36 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.381 1.072 . . . . 72.34 110.703 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.6 p -159.21 163.46 35.91 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.488 -0.778 . . . . 71.41 111.066 -175.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.4 mt -121.86 125.98 47.68 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 108.535 -0.913 . . . . 74.2 108.535 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.579 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.1 ttm -98.64 99.82 10.98 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 106.897 -1.519 . . . . 74.23 106.897 174.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.603 HD12 HD12 ' A' ' 84' ' ' LEU . 19.1 mm -85.41 110.67 19.78 Favored 'Isoleucine or valine' 0 C--O 1.242 0.662 0 N-CA-C 108.765 -0.828 . . . . 75.42 108.765 -172.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -101.25 173.68 24.38 Favored Glycine 0 C--O 1.247 0.931 0 N-CA-C 109.802 -1.319 . . . . 63.12 109.802 173.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.622 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 10.5 p-10 -74.93 -44.66 47.32 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 122.87 0.468 . . . . 64.33 110.022 175.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -86.81 -41.72 13.85 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.448 0.699 . . . . 70.23 111.468 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 36.4 p90 -131.2 171.62 13.08 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 121.247 0.546 . . . . 72.4 112.204 -164.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.603 HD12 HD12 ' A' ' 79' ' ' ILE . 14.1 tp -139.51 110.8 6.99 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.731 1.212 . . . . 64.53 107.915 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.579 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 66.7 m -95.42 108.18 20.37 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.088 -1.079 . . . . 74.51 108.088 -177.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.57 HG13 HD13 ' A' ' 101' ' ' ILE . 12.0 mm -87.01 102.9 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.501 0.72 . . . . 75.21 109.152 -173.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -84.2 128.08 34.34 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 107.33 -1.359 . . . . 73.2 107.33 175.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.43 ' HA ' ' H ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -148.93 168.1 23.98 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.603 0.761 . . . . 73.21 111.867 -171.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -71.42 122.79 21.01 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.197 1.399 . . . . 71.31 109.799 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -71.45 -12.5 61.43 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 113.147 0.795 . . . . 74.12 113.147 -170.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.7 mmm -78.06 -30.94 50.02 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.754 -0.461 . . . . 75.3 109.754 175.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.6 t -83.34 144.94 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 107.923 -1.14 . . . . 75.33 107.923 175.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -102.14 158.65 16.01 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.3 0.64 . . . . 72.4 111.636 -171.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -75.68 -24.73 56.31 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.977 0.911 . . . . 73.44 112.143 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -59.86 -27.32 66.58 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.423 0.689 . . . . 64.44 111.223 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.2 m -92.79 -35.55 13.35 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.954 0.902 . . . . 73.53 112.412 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 24.5 mt -93.28 -45.66 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 CA-C-N 117.861 0.301 . . . . 71.31 111.212 -170.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -53.5 -46.29 98.19 Favored Pre-proline 0 N--CA 1.492 1.674 0 N-CA-C 114.522 1.304 . . . . 72.4 114.522 -174.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -55.41 -39.59 90.2 Favored 'Trans proline' 0 C--N 1.392 2.866 0 C-N-CA 121.803 1.668 . . . . 71.04 112.168 175.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -68.22 -40.45 82.08 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.466 -0.788 . . . . 75.53 110.382 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.57 HD13 HG13 ' A' ' 86' ' ' ILE . 84.8 mt -62.48 -52.01 65.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.551 0.74 . . . . 73.12 110.364 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 79.4 mt -61.32 -37.54 77.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.369 0.668 . . . . 74.53 110.83 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.25 -47.69 72.92 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.431 0.692 . . . . 75.03 111.057 178.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 98.4 mt -68.44 -35.26 77.35 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.761 0.825 . . . . 75.11 111.99 -179.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.0 mp -69.34 -23.79 63.82 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.315 0.646 . . . . 73.01 110.492 175.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 53.8 m -78.9 -44.96 21.58 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.265 0.626 . . . . 72.23 109.993 173.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -57.46 -49.58 75.82 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.017 0.927 . . . . 73.33 110.483 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -50.57 -60.74 2.71 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.556 1.142 . . . . 74.52 111.366 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.4 mt -75.43 -19.11 59.68 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 115.682 -0.69 . . . . 74.54 112.058 -170.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.53 -46.72 14.07 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.599 0.76 . . . . 74.45 110.769 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -80.15 -15.02 57.99 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 115.92 -0.582 . . . . 73.13 111.208 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 84.45 19.27 60.63 Favored Glycine 0 C--N 1.35 1.316 0 CA-C-N 116.405 -0.361 . . . . 74.0 112.796 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.15 167.75 17.12 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.442 1.097 . . . . 73.33 111.148 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.36 139.4 34.18 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.323 1.049 . . . . 64.45 110.172 -174.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 108.868 -0.79 . . . . 70.11 108.868 165.857 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.0 mt . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.136 -0.69 . . . . 75.32 109.136 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -64.15 118.54 8.72 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.848 1.259 . . . . 74.13 110.389 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 42.1 mm -122.37 113.42 38.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 N-CA-C 106.193 -1.78 . . . . 75.22 106.193 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -105.57 119.96 40.44 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 106.891 -1.522 . . . . 65.43 106.891 -175.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.483 HG22 ' HD2' ' A' ' 98' ' ' LYS . 12.3 t -109.58 111.81 23.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-O 121.834 0.826 . . . . 72.12 108.934 -171.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.0 mt -91.56 147.6 22.89 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.152 -0.931 . . . . 73.3 111.342 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.9 p -81.66 145.86 30.34 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.669 -1.15 . . . . 74.25 110.011 176.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 50.1 p -115.81 176.65 1.44 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 107.939 -1.134 . . . . 73.32 107.939 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -49.8 -30.35 22.89 Favored 'Trans proline' 0 C--N 1.384 2.41 0 C-N-CA 122.079 1.852 . . . . 74.33 113.4 165.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -86.19 146.26 26.63 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 109.083 -0.71 . . . . 73.34 109.083 174.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -88.76 -36.22 16.24 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.946 0.898 . . . . 71.23 110.838 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -91.49 -17.39 25.78 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.461 1.104 . . . . 74.05 111.982 -171.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -99.77 109.34 21.77 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.219 -1.03 . . . . 75.45 108.219 169.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.2 tp -114.96 126.77 55.16 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.696 -0.853 . . . . 73.34 108.696 -175.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -92.47 110.08 21.48 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.088 0.955 . . . . 75.34 110.294 -170.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -92.56 127.19 37.96 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.599 0.76 . . . . 74.23 109.642 -177.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.3 tp -117.65 137.94 52.31 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.565 0.746 . . . . 74.14 109.835 -179.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.0 t -89.99 121.27 31.93 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.314 -0.995 . . . . 65.12 108.314 170.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 34.3 p -99.6 0.62 42.53 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.455 0.539 . . . . 74.53 112.455 -176.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -103.53 33.11 3.49 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.022 0.529 . . . . 73.35 111.721 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.68 -44.99 3.29 Favored Glycine 0 C--N 1.347 1.151 0 CA-C-O 119.755 -0.47 . . . . 73.44 113.97 171.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.507 ' HB3' HD23 ' A' ' 109' ' ' LEU . 9.3 mm-40 -59.29 92.06 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.68 0.792 . . . . 73.42 112.764 -177.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.445 ' HE2' ' HB3' ' A' ' 82' ' ' ASP . 51.4 ttm -78.94 138.54 38.13 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 114.822 -1.081 . . . . 75.41 109.104 173.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.3 mt -63.86 -56.14 17.59 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.772 0.829 . . . . 72.34 111.279 -172.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 107.895 -1.15 . . . . 72.02 107.895 173.096 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 CA--C 1.547 0.847 0 CA-C-O 121.255 0.55 . . . . 65.44 111.27 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.79 158.13 20.49 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.585 1.154 . . . . 75.32 108.383 177.186 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.5 m -76.58 93.29 3.56 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.314 0.645 . . . . 74.45 110.038 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.434 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 56.1 mt -74.87 104.54 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.596 0.758 . . . . 72.23 110.246 -177.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.522 HG22 ' HE3' ' A' ' 78' ' ' MET . 46.4 t -81.29 108.69 14.79 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 123.443 0.697 . . . . 73.2 109.165 -178.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 53.3 mt -106.06 108.36 24.88 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 N-CA-C 107.348 -1.353 . . . . 74.05 107.348 175.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -94.71 166.01 12.21 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 108.725 -0.842 . . . . 73.52 108.725 175.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.444 ' HA ' HD12 ' A' ' 58' ' ' ILE . 30.7 p30 -70.9 -8.9 56.19 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 120.65 0.262 . . . . 74.3 111.548 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.3 p -85.56 -25.31 26.82 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.494 0.718 . . . . 73.31 110.928 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -86.39 70.68 10.51 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.254 0.622 . . . . 74.41 109.495 177.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -56.65 -37.45 70.79 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.529 -0.759 . . . . 71.12 111.025 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -53.08 -44.83 67.86 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.614 1.166 . . . . 75.42 111.734 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.6 mt -73.39 -30.39 63.24 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 116.084 -0.507 . . . . 74.02 111.659 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.444 HD12 ' HA ' ' A' ' 52' ' ' ASN . 77.6 mt -70.17 -43.47 78.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 123.648 0.779 . . . . 74.41 110.66 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -54.08 -39.52 66.4 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.647 0.779 . . . . 65.22 112.703 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -99.08 28.84 4.17 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 120.88 0.371 . . . . 75.24 111.907 -177.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.6 t -151.25 100.31 2.74 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 108.652 -0.869 . . . . 75.34 108.652 173.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -56.95 -38.34 72.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.769 0.828 . . . . 74.33 110.288 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.508 HD11 HD12 ' A' ' 105' ' ' LEU . 31.8 tp -59.91 -45.08 93.72 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 124.124 0.89 . . . . 74.41 110.492 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.61 -43.41 96.94 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.1 0.56 . . . . 70.21 111.645 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -56.29 -50.65 70.82 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 124.14 0.9 . . . . 72.41 110.758 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 18.1 mm100 -66.4 -39.03 88.77 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 124.299 1.0 . . . . 73.11 112.365 -177.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 77.8 mt -64.94 -50.61 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 122.561 0.344 . . . . 74.3 110.883 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -67.51 -31.43 71.54 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.696 0.398 . . . . 74.04 111.736 179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.8 tp -69.98 -53.59 17.05 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.04 0.536 . . . . 74.35 110.734 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -71.95 -29.32 64.14 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.672 -0.694 . . . . 64.23 111.205 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.65 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 37.9 m -132.29 93.23 26.34 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 123.119 0.568 . . . . 63.23 110.009 -176.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.29 -10.43 22.41 Favored 'Trans proline' 0 C--N 1.37 1.689 0 C-N-CA 122.981 2.454 . . . . 62.42 113.357 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -82.18 -3.05 90.69 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-O 119.988 -0.34 . . . . 74.3 113.407 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 91.7 t -77.18 121.73 30.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 C-N-CA 123.542 0.737 . . . . 75.01 109.66 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -74.47 -48.78 25.3 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.854 0.862 . . . . 74.43 109.706 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.8 t -162.5 154.81 19.02 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.401 -1.272 . . . . 61.11 110.717 -170.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.2 mt -108.35 158.11 17.79 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.096 1.359 . . . . 75.13 108.745 169.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.522 ' HE3' HG22 ' A' ' 49' ' ' VAL . 52.0 ttm -137.49 113.92 10.21 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.246 -1.02 . . . . 75.35 108.246 170.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.591 HD12 HD11 ' A' ' 84' ' ' LEU . 22.0 mm -88.91 118.55 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 N-CA-C 107.958 -1.127 . . . . 74.0 107.958 -175.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -108.51 -164.21 20.86 Favored Glycine 0 C--O 1.242 0.652 0 N-CA-C 111.852 -0.499 . . . . 75.45 111.852 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -73.13 -74.68 0.16 Allowed 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.302 -0.999 . . . . 70.45 108.302 174.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.445 ' HB3' ' HE2' ' A' ' 39' ' ' MET . 6.3 p-10 -87.48 -19.79 27.46 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.088 1.355 . . . . 74.14 111.122 -176.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -119.77 160.49 22.49 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.808 0.67 . . . . 75.23 112.808 -164.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.591 HD11 HD12 ' A' ' 79' ' ' ILE . 28.3 tp -135.99 109.77 8.11 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.415 -1.266 . . . . 73.42 107.803 170.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.44 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 36.9 m -96.21 108.44 20.91 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.317 -0.623 . . . . 74.24 109.317 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 26.3 mm -90.67 127.56 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 108.984 -0.747 . . . . 70.1 108.984 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -107.8 128.52 54.67 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 108.011 -1.107 . . . . 71.11 108.011 178.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.6 170.25 16.25 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.75 0.82 . . . . 74.53 110.106 178.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -85.26 134.78 34.12 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 109.515 -0.55 . . . . 74.32 109.515 173.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.2 ptp180 -55.1 -31.31 61.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.31 1.044 . . . . 74.33 113.656 -174.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 84.0 mtp -67.49 -26.79 66.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 122.721 0.408 . . . . 74.11 111.146 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 18.6 t -89.41 136.5 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 107.902 -1.147 . . . . 73.0 107.902 173.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -91.85 150.51 21.02 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.899 0.48 . . . . 74.41 111.537 -173.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -68.09 -15.71 63.71 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.243 0.617 . . . . 71.21 110.49 169.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -57.7 -31.01 65.97 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.115 0.966 . . . . 73.41 111.555 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.9 t -103.19 -17.12 15.49 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.406 0.682 . . . . 71.31 111.405 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.65 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 68.3 mt -100.96 -58.64 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 122.961 0.504 . . . . 74.02 111.13 -171.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.483 ' HD2' HG22 ' A' ' 21' ' ' THR . 27.7 ttpp -59.92 -46.24 98.2 Favored Pre-proline 0 CA--C 1.567 1.602 0 N-CA-C 114.606 1.336 . . . . 70.12 114.606 -170.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -60.29 -35.16 92.61 Favored 'Trans proline' 0 C--N 1.396 3.057 0 CA-C-N 122.002 1.751 . . . . 74.21 112.02 178.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -66.74 -46.45 75.39 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.463 -0.79 . . . . 70.54 109.837 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 50.1 mt -67.42 -45.86 84.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 O-C-N 123.979 0.799 . . . . 74.33 111.528 -177.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.69 -40.67 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 122.746 0.418 . . . . 75.22 110.694 178.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -64.27 -41.28 96.99 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.894 0.746 . . . . 64.42 110.91 177.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.5 -36.84 85.49 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.639 0.776 . . . . 74.21 111.398 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.508 HD12 HD11 ' A' ' 63' ' ' LEU . 8.2 mp -69.25 -33.4 73.2 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.477 0.711 . . . . 64.53 109.939 175.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.9 m -71.27 -34.6 70.85 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.176 0.59 . . . . 61.13 109.642 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -69.09 -56.64 7.09 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 122.975 0.51 . . . . 74.02 110.266 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.92 -42.94 85.85 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.681 1.192 . . . . 71.31 111.24 -173.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.507 HD23 ' HB3' ' A' ' 38' ' ' GLU . 95.8 mt -73.42 -34.82 65.67 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.123 0.569 . . . . 72.54 111.418 178.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.16 -29.27 68.12 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 122.965 0.506 . . . . 71.15 111.35 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -74.3 -34.55 63.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.802 -0.635 . . . . 74.43 110.063 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.15 35.55 53.03 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-N 115.535 -0.757 . . . . 73.43 112.358 -179.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -98.74 -179.93 4.46 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.642 0.777 . . . . 74.34 110.705 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -87.81 143.38 27.17 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.936 0.494 . . . . 74.45 110.04 174.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 CA--C 1.546 0.794 0 N-CA-C 109.341 -0.614 . . . . 75.05 109.341 171.082 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.7 mp . . . . . 0 CA--C 1.545 0.784 0 CA-C-O 121.432 0.634 . . . . 74.13 112.042 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.1 m80 -87.71 137.28 32.47 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 125.108 1.363 . . . . 63.12 109.393 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.402 ' HB ' HG21 ' A' ' 102' ' ' ILE . 51.5 mm -121.76 117.16 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 107.019 -1.474 . . . . 73.33 107.019 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.522 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.8 ttmm -90.62 138.0 31.91 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.465 -0.939 . . . . 74.53 108.465 -178.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 85.2 m -105.55 124.61 49.84 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 108.395 -0.965 . . . . 65.45 108.395 174.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.6 mt -117.54 136.26 53.37 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 108.747 -0.834 . . . . 73.15 108.747 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.3 p -68.06 144.68 54.99 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.854 0.862 . . . . 74.44 110.432 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.3 p -126.2 147.84 61.18 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.364 1.066 . . . . 71.43 109.312 -173.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.94 -28.91 66.81 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 122.537 2.158 . . . . 75.22 112.033 171.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -87.16 117.23 25.77 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.196 0.999 . . . . 73.04 108.718 176.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -73.82 -29.78 62.34 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.535 0.734 . . . . 74.45 112.342 -175.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -74.35 -26.36 60.09 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 122.644 0.378 . . . . 75.33 110.588 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -90.11 158.91 17.06 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.411 0.684 . . . . 72.12 110.856 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.3 tp -158.67 123.13 4.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.335 -0.987 . . . . 72.14 108.335 168.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -84.22 129.95 34.86 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.041 0.936 . . . . 74.1 110.636 -174.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -118.57 118.56 32.01 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.257 1.023 . . . . 73.04 108.512 174.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.522 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 60.6 tp -100.88 124.65 46.87 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 109.218 -0.66 . . . . 74.33 109.218 -172.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.0 m -80.92 105.37 12.09 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.453 -0.943 . . . . 75.01 108.453 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 57.2 p -91.52 -6.16 52.97 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 112.943 0.719 . . . . 63.04 112.943 -168.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -97.15 178.02 5.39 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.075 0.95 . . . . 73.21 109.442 178.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.42 -11.72 29.16 Favored Glycine 0 N--CA 1.48 1.613 0 N-CA-C 114.208 0.443 . . . . 74.44 114.208 -175.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.464 ' HB3' HD23 ' A' ' 109' ' ' LEU . 11.4 mp0 -81.23 89.02 6.01 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.52 1.128 . . . . 72.44 109.832 175.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.7 ttt -93.53 136.45 33.8 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 108.063 -1.088 . . . . 61.34 108.063 172.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.409 ' HB3' HG11 ' A' ' 115' ' ' VAL . 77.5 mt -68.53 -59.51 3.09 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.933 0.493 . . . . 73.12 112.106 -167.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.528 ' HB2' ' HA ' ' A' ' 81' ' ' ASP . 26.3 mt-30 . . . . . 0 N--CA 1.482 1.162 0 C-N-CA 123.721 0.808 . . . . 73.4 109.46 172.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.3 m . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.855 0.36 . . . . 74.42 110.584 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -94.64 132.47 39.32 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 108.385 -0.969 . . . . 74.23 108.385 173.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.3 p -70.01 115.71 9.53 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.661 0.785 . . . . 70.31 110.217 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.1 mt -74.33 102.02 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 109.017 -0.734 . . . . 74.43 109.017 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 89.7 t -91.65 106.97 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.604 -0.888 . . . . 74.54 108.604 -179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.497 HG12 ' HB3' ' A' ' 57' ' ' LEU . 66.4 mt -104.39 110.0 29.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 N-CA-C 108.065 -1.087 . . . . 71.03 108.065 -178.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.48 ' HG2' ' HB3' ' A' ' 76' ' ' SER . 54.1 mtmt -91.34 161.24 15.1 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.247 -0.649 . . . . 71.11 109.247 177.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.448 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 27.6 p30 -63.64 -18.27 63.76 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.0 0.92 . . . . 72.02 112.307 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -82.85 -27.17 31.0 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.67 0.788 . . . . 73.54 111.735 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.448 ' O ' HG13 ' A' ' 58' ' ' ILE . 31.1 m-20 -83.67 77.17 9.91 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.519 0.728 . . . . 72.42 111.601 -173.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -49.68 -46.31 49.78 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.196 0.998 . . . . 73.14 112.084 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -54.19 -48.02 71.43 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.495 1.118 . . . . 75.23 111.467 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.497 ' HB3' HG12 ' A' ' 50' ' ' ILE . 83.6 mt -73.6 -28.96 62.1 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 115.525 -0.761 . . . . 74.01 111.347 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.474 HG23 ' HG2' ' A' ' 65' ' ' GLN . 87.9 mt -70.81 -39.32 75.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 123.508 0.723 . . . . 63.43 110.393 178.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -66.16 -23.55 66.49 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.556 0.342 . . . . 74.44 111.516 174.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -72.05 -10.68 60.11 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 112.869 0.692 . . . . 75.33 112.869 172.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.4 m -140.83 105.31 4.87 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 122.841 0.456 . . . . 74.44 110.513 -177.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -59.31 -32.8 70.39 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.62 0.768 . . . . 74.45 110.401 174.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.2 tp -60.3 -44.73 95.15 Favored 'General case' 0 C--N 1.356 0.849 0 C-N-CA 123.988 0.915 . . . . 74.21 110.876 175.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.94 99.47 Favored 'General case' 0 C--N 1.357 0.906 0 O-C-N 123.845 0.715 . . . . 61.12 110.511 -178.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.474 ' HG2' HG23 ' A' ' 58' ' ' ILE . 82.8 mt-30 -57.4 -43.89 84.06 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 124.509 1.13 . . . . 75.25 110.862 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -69.23 -39.29 78.61 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 123.569 0.543 . . . . 63.23 112.026 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.446 HG23 HD22 ' A' ' 77' ' ' LEU . 59.8 mt -64.99 -49.07 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.435 0.694 . . . . 72.35 110.658 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -69.88 -27.23 64.64 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.121 0.568 . . . . 73.43 111.602 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 66.6 tp -69.66 -48.52 59.54 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.141 0.576 . . . . 74.43 110.845 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -74.48 -33.37 62.85 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.432 -0.804 . . . . 74.24 111.442 -177.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 52.4 t -142.95 94.18 6.48 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 108.759 -0.83 . . . . 74.34 108.759 -178.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -71.44 -2.01 10.61 Favored 'Trans proline' 0 C--N 1.373 1.851 0 C-N-CA 123.245 2.63 . . . . 75.41 112.733 174.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.69 -20.24 74.34 Favored Glycine 0 C--N 1.355 1.608 0 N-CA-C 111.687 -0.565 . . . . 74.25 111.687 177.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 85.9 t -65.39 118.3 7.68 Favored 'Isoleucine or valine' 0 C--N 1.354 0.789 0 C-N-CA 123.649 0.78 . . . . 73.01 109.713 175.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.448 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 40.5 mt-10 -82.15 -41.98 19.69 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.205 1.002 . . . . 61.52 110.871 -175.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.48 ' HB3' ' HG2' ' A' ' 51' ' ' LYS . 74.6 p -159.14 165.53 33.57 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.632 0.73 . . . . 61.51 111.999 -175.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.446 HD22 HG23 ' A' ' 67' ' ' ILE . 46.5 mt -129.1 127.78 42.16 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 106.905 -1.517 . . . . 72.4 106.905 176.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.489 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.3 ttm -103.32 109.1 20.59 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 108.11 -1.07 . . . . 75.23 108.11 173.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.596 HD11 HD12 ' A' ' 84' ' ' LEU . 13.6 mm -84.29 103.8 11.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 107.046 -1.465 . . . . 73.12 107.046 177.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.97 -168.74 43.14 Favored Glycine 0 C--O 1.245 0.816 0 N-CA-C 111.617 -0.593 . . . . 71.45 111.617 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.528 ' HA ' ' HB2' ' A' ' 41' ' ' GLN . 1.9 m-20 -76.26 -61.63 1.88 Allowed 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.678 -0.86 . . . . 74.42 108.678 -178.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -97.04 -14.73 21.42 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.112 0.965 . . . . 74.33 111.361 -178.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -134.65 156.25 49.07 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.381 0.512 . . . . 70.33 112.381 -159.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.596 HD12 HD11 ' A' ' 79' ' ' ILE . 22.6 tp -125.14 114.97 19.73 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.889 1.275 . . . . 74.22 107.921 174.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.489 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 30.8 m -102.44 108.86 20.33 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.452 -0.944 . . . . 71.32 108.452 -178.063 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.0 mm -87.4 136.95 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 107.908 -1.145 . . . . 74.43 107.908 -178.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -123.07 126.43 47.07 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 108.657 -0.868 . . . . 71.14 108.657 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -129.01 167.43 17.48 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.333 0.653 . . . . 74.34 109.573 177.111 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -59.71 141.94 54.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.075 0.95 . . . . 64.53 110.01 174.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -54.38 -38.8 66.56 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.513 0.725 . . . . 74.44 112.275 -172.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 45.3 ttp -75.81 -28.13 58.21 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.618 0.767 . . . . 75.43 111.216 -175.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.4 HG12 HD12 ' A' ' 97' ' ' ILE . 44.3 t -72.04 134.47 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 N-CA-C 108.458 -0.942 . . . . 71.13 108.458 172.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -104.13 160.78 14.57 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.149 0.579 . . . . 75.41 110.929 -176.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -77.94 -13.78 59.76 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.471 1.109 . . . . 72.43 113.547 -175.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -64.56 -28.36 69.59 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.28 0.632 . . . . 75.21 111.919 -171.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.2 m -95.24 -23.93 17.02 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.779 0.832 . . . . 74.32 111.546 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.4 HD12 HG12 ' A' ' 92' ' ' VAL . 50.7 mt -89.98 -48.93 14.13 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 123.813 0.845 . . . . 75.14 111.294 -168.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.496 ' HZ2' ' HB3' ' A' ' 98' ' ' LYS . 9.7 mtpm? -51.62 -55.51 29.05 Favored Pre-proline 0 N--CA 1.487 1.395 0 CA-C-O 117.428 -1.272 . . . . 74.21 113.282 -174.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -59.85 -38.19 81.33 Favored 'Trans proline' 0 C--N 1.396 3.049 0 CA-C-N 121.577 1.599 . . . . 75.12 112.314 -175.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.45 -48.03 57.86 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.049 0.54 . . . . 74.32 110.523 -175.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 13.1 mt -69.95 -45.23 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.49 0.716 . . . . 73.42 111.186 -178.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.402 HG21 ' HB ' ' A' ' 19' ' ' ILE . 58.1 mt -58.41 -37.4 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.067 0.547 . . . . 75.2 110.813 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -67.84 -45.77 73.7 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 123.687 0.617 . . . . 73.41 110.279 175.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.11 -33.74 72.53 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 123.867 0.867 . . . . 73.11 111.588 177.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.5 mp -74.05 -35.34 64.3 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.171 0.988 . . . . 65.05 110.654 178.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 85.5 m -72.07 -31.19 65.87 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 109.293 -0.632 . . . . 72.12 109.293 178.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.524 ' HA ' ' HE2' ' A' ' 107' ' ' LYS . 10.1 mmpt? -73.32 -52.96 12.02 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 123.932 0.893 . . . . 75.42 111.101 175.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -55.7 -53.14 60.3 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.783 0.833 . . . . 74.44 111.043 -178.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.464 HD23 ' HB3' ' A' ' 38' ' ' GLU . 78.7 mt -74.12 -10.8 59.98 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 114.844 -1.071 . . . . 73.42 111.417 -176.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.84 -27.4 62.87 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.706 0.402 . . . . 73.0 110.845 170.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -79.62 -52.04 8.49 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 107.51 -1.293 . . . . 75.44 107.51 168.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.82 -8.6 75.16 Favored Glycine 0 C--N 1.354 1.582 0 N-CA-C 115.838 1.095 . . . . 75.15 115.838 163.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.18 -70.46 0.27 Allowed 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 117.669 0.734 . . . . 61.44 111.108 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -134.1 126.09 29.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.122 0.569 . . . . 72.41 110.762 -171.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.409 HG11 ' HB3' ' A' ' 40' ' ' LEU . 3.9 p . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 107.997 -1.112 . . . . 73.42 107.997 158.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.511 HD11 ' HA ' ' A' ' 106' ' ' THR . 74.7 mt . . . . . 0 CA--C 1.536 0.434 0 N-CA-C 108.941 -0.763 . . . . 74.33 108.941 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.409 ' H ' ' HB3' ' A' ' 36' ' ' ASP . 48.2 m80 -68.32 120.54 14.61 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 124.293 1.037 . . . . 73.12 110.848 -174.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.4 mm -118.19 123.71 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 N-CA-C 108.079 -1.082 . . . . 73.52 108.079 -173.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 56.6 tptt -96.78 112.27 24.09 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.684 1.194 . . . . 75.12 109.108 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.451 HG21 ' HE3' ' A' ' 98' ' ' LYS . 59.8 m -92.49 113.47 25.76 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 108.847 -0.797 . . . . 74.45 108.847 -178.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.494 HD23 ' HE3' ' A' ' 20' ' ' LYS . 95.4 mt -122.26 138.01 54.64 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.625 1.17 . . . . 74.42 109.591 -171.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.4 p -81.02 147.81 30.01 Favored 'General case' 0 C--O 1.24 0.56 0 O-C-N 124.073 0.858 . . . . 71.23 110.553 -178.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 36.6 p -125.38 158.0 65.76 Favored Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 124.136 0.974 . . . . 75.03 109.373 -174.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.13 -32.1 30.79 Favored 'Trans proline' 0 C--N 1.389 2.679 0 C-N-CA 123.289 2.66 . . . . 71.41 113.684 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -100.71 121.46 41.7 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 108.918 -0.771 . . . . 74.21 108.918 173.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -73.82 -15.37 61.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.112 0.565 . . . . 74.01 111.303 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.436 ' O ' ' HA ' ' A' ' 87' ' ' ASN . 13.2 m120 -71.9 -19.05 61.99 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 122.655 0.382 . . . . 70.22 110.609 170.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -102.41 159.7 15.19 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.56 1.144 . . . . 71.32 110.082 172.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.0 tp -160.28 120.91 2.96 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.14 -0.689 . . . . 75.03 109.14 176.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.451 ' HZ1' ' HB2' ' A' ' 31' ' ' LYS . 4.9 ttmp? -82.44 120.75 25.86 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.044 0.538 . . . . 73.3 111.131 -176.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -105.24 111.86 24.76 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.381 -0.97 . . . . 72.34 108.381 169.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 59.5 tp -108.83 128.28 54.76 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.669 0.787 . . . . 73.25 109.665 -171.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 p -80.5 104.53 11.1 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.909 -0.774 . . . . 74.31 108.909 179.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.5 p -101.11 -6.74 23.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.743 0.817 . . . . 55.33 111.302 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . 0.409 ' HB3' ' H ' ' A' ' 18' ' ' HIS . 8.0 p-10 -69.44 -37.7 77.48 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.167 0.587 . . . . 75.43 110.316 177.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.31 -12.5 4.96 Favored Glycine 0 C--N 1.349 1.292 0 C-N-CA 123.371 0.51 . . . . 71.13 113.031 178.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.508 ' HG2' ' HB3' ' A' ' 109' ' ' LEU . 9.6 tp10 -78.04 149.03 34.06 Favored 'General case' 0 C--N 1.356 0.869 0 CA-C-N 117.567 0.683 . . . . 74.21 109.965 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 7.5 tpt -111.77 142.66 43.85 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.222 0.609 . . . . 75.31 109.992 -170.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.642 HD21 HD22 ' A' ' 109' ' ' LEU . 89.8 mt -86.0 -44.42 12.35 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.409 0.684 . . . . 74.45 111.378 -177.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.406 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.9 tp60 . . . . . 0 CA--C 1.561 1.376 0 N-CA-C 109.194 -0.669 . . . . 73.44 109.194 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.2 t . . . . . 0 N--CA 1.476 0.847 0 CA-C-O 121.125 0.488 . . . . 73.23 109.817 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.28 -176.31 3.26 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.301 1.041 . . . . 71.44 110.185 177.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.5 m -73.49 92.88 1.93 Allowed 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 109.355 -0.609 . . . . 75.22 109.355 173.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.553 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 46.9 mt -75.35 97.87 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 108.758 -0.83 . . . . 74.34 108.758 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.4 t -86.83 107.27 16.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.017 -1.105 . . . . 74.33 108.017 -176.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.6 mt -102.59 108.4 24.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 107.884 -1.154 . . . . 73.53 107.884 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -95.66 155.96 16.53 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.195 0.598 . . . . 65.42 109.66 -176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.432 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 34.5 p30 -60.47 -18.87 54.27 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.563 0.745 . . . . 72.42 112.364 -178.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.5 p -77.56 -41.27 39.53 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.774 0.83 . . . . 74.25 111.262 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -86.69 79.75 8.77 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.502 0.721 . . . . 75.33 110.552 -171.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -66.53 -22.82 66.17 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.28 -0.873 . . . . 74.32 112.21 -173.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -57.5 -46.88 83.24 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 121.052 0.453 . . . . 74.11 110.377 178.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.3 mt -73.2 -35.65 66.38 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.662 0.785 . . . . 70.15 110.523 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.27 -42.54 93.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.337 1.055 . . . . 62.21 110.283 177.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.43 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 83.1 m-20 -69.45 -29.19 66.83 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.159 0.584 . . . . 72.54 111.875 177.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -73.9 -33.14 63.88 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.142 0.577 . . . . 74.12 111.525 175.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.0 p -110.97 92.24 3.97 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 108.798 -0.816 . . . . 71.45 108.798 176.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -57.46 -23.4 49.61 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.718 0.807 . . . . 71.35 111.352 -175.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.4 tp -58.12 -46.73 85.09 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.062 1.345 . . . . 72.2 110.872 171.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.72 -39.27 93.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.939 0.896 . . . . 71.14 110.707 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.43 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 95.6 mt-30 -55.06 -47.84 74.31 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 123.651 0.594 . . . . 72.45 109.827 175.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -65.61 -45.31 83.64 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 115.135 -0.939 . . . . 74.1 112.845 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 69.2 mt -65.09 -49.1 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 123.112 0.565 . . . . 73.52 110.663 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -68.24 -30.12 69.1 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 116.107 -0.497 . . . . 75.41 111.372 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 41.0 tp -73.32 -46.99 46.17 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.107 0.563 . . . . 74.43 111.679 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -83.27 -17.42 42.65 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.316 0.647 . . . . 74.35 111.594 -173.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 51.6 t -141.96 105.58 5.73 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 123.352 0.661 . . . . 72.02 109.604 172.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.45 -8.53 22.77 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.949 2.433 . . . . 73.41 112.803 176.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.528 ' HA3' HG12 ' A' ' 92' ' ' VAL . . . -76.61 -21.9 73.78 Favored Glycine 0 C--N 1.345 1.037 0 CA-C-N 116.57 -0.286 . . . . 71.01 113.29 -178.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.53 122.68 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 122.989 0.516 . . . . 65.05 109.673 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.432 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 11.1 pt-20 -93.04 -33.77 13.97 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.755 0.822 . . . . 73.23 111.23 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.9 p -161.9 160.29 27.76 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.459 0.647 . . . . 63.44 112.023 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.408 HD22 HD11 ' A' ' 86' ' ' ILE . 40.7 mt -121.08 139.23 53.6 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.155 -1.424 . . . . 74.12 107.155 174.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.541 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 48.6 ttm -113.06 109.22 18.47 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 107.215 -1.402 . . . . 72.4 107.215 173.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.605 HG23 HG11 ' A' ' 115' ' ' VAL . 39.8 mm -92.49 127.18 44.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 109.342 -0.614 . . . . 72.21 109.342 -176.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -114.22 175.61 16.38 Favored Glycine 0 C--O 1.241 0.566 0 N-CA-C 109.677 -1.369 . . . . 42.01 109.677 166.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 23.5 m-20 -72.71 -44.61 61.5 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.582 0.706 . . . . 65.23 110.468 177.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -104.38 -39.51 6.42 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 125.014 1.326 . . . . 65.2 110.933 -174.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 18.1 p90 -111.21 155.58 22.73 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.292 0.637 . . . . 75.12 111.201 -175.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.457 HD21 HD12 ' A' ' 86' ' ' ILE . 54.3 tp -120.79 150.45 40.99 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 107.425 -1.324 . . . . 74.43 107.425 171.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.541 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 50.7 m -141.37 109.46 5.81 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.218 0.607 . . . . 53.24 109.76 175.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.468 HG13 HD13 ' A' ' 101' ' ' ILE . 29.5 mm -88.76 139.53 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 109.242 -0.651 . . . . 74.32 109.242 -178.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . 0.436 ' HA ' ' O ' ' A' ' 28' ' ' ASN . 33.5 m-80 -118.35 133.82 55.56 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.454 0.702 . . . . 75.11 109.571 175.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.478 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -128.11 168.74 14.95 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.585 0.754 . . . . 73.42 109.978 -178.832 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.403 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 14.1 t70 -72.95 149.5 43.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.274 0.63 . . . . 71.55 110.179 173.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -50.14 -41.04 48.09 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.653 1.181 . . . . 71.13 114.184 -172.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 20.0 ptp -83.41 -18.03 40.14 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 122.752 0.421 . . . . 75.34 111.75 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.528 HG12 ' HA3' ' A' ' 73' ' ' GLY . 27.4 t -81.46 127.65 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.068 0.547 . . . . 72.44 109.545 -171.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -86.8 130.68 34.37 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.785 0.834 . . . . 74.21 110.601 -169.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.478 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 45.4 m95 -59.16 -31.41 68.96 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.507 0.723 . . . . 75.03 112.141 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -61.35 -26.19 67.66 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 122.767 0.427 . . . . 73.35 111.445 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.7 t -86.99 -18.73 29.97 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.698 0.799 . . . . 44.35 111.367 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.441 HD13 HG11 ' A' ' 92' ' ' VAL . 10.9 mt -104.09 -44.16 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.348 0 C-N-CA 123.043 0.537 . . . . 74.25 111.586 -170.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.451 ' HE3' HG21 ' A' ' 21' ' ' THR . 54.5 mtpt -52.91 -52.18 67.46 Favored Pre-proline 0 N--CA 1.491 1.595 0 C-N-CA 124.963 1.305 . . . . 74.24 113.706 -172.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -56.5 -40.07 87.0 Favored 'Trans proline' 0 C--N 1.393 2.919 0 C-N-CA 121.909 1.74 . . . . 74.24 112.049 -178.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -61.84 -53.76 51.44 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.79 -1.096 . . . . 75.31 110.03 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.468 HD13 HG13 ' A' ' 86' ' ' ILE . 48.2 mt -61.93 -51.06 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.077 0.951 . . . . 75.11 111.833 -176.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 83.2 mt -58.56 -40.17 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 123.308 0.643 . . . . 73.3 110.824 -177.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -66.99 -42.51 84.9 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.944 0.498 . . . . 71.12 110.74 178.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.7 mt -65.79 -35.57 81.08 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.163 0.985 . . . . 74.51 111.757 178.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.36 -35.94 80.69 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.687 0.795 . . . . 65.11 109.95 174.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.511 ' HA ' HD11 ' A' ' 17' ' ' ILE . 26.3 m -74.26 -29.83 61.85 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.073 0.549 . . . . 74.02 110.054 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -65.53 -52.41 52.81 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.456 0.702 . . . . 73.24 110.31 174.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -66.88 -52.62 41.24 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.306 -0.861 . . . . 73.42 111.744 -174.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.642 HD22 HD21 ' A' ' 40' ' ' LEU . 95.4 mt -67.56 -18.03 64.86 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.551 -0.75 . . . . 64.21 111.528 -174.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.33 -19.4 65.45 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.717 0.807 . . . . 73.21 112.032 174.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -74.73 -29.23 61.1 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.992 0.517 . . . . 73.32 110.434 173.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.97 28.04 63.32 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.947 -0.57 . . . . 74.33 112.85 -177.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -115.81 -178.65 3.44 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.216 1.006 . . . . 62.12 110.064 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -70.14 169.47 13.49 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.189 0.596 . . . . 63.43 110.336 172.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.605 HG11 HG23 ' A' ' 79' ' ' ILE . 7.1 p . . . . . 0 N--CA 1.477 0.905 0 C-N-CA 123.896 0.878 . . . . 75.31 109.707 175.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.7 mt . . . . . 0 N--CA 1.475 0.824 0 CA-C-O 120.949 0.404 . . . . 75.23 110.747 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -77.31 112.92 14.53 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.254 1.021 . . . . 72.54 110.627 -175.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.449 ' HB ' HG21 ' A' ' 102' ' ' ILE . 50.1 mm -121.63 119.24 58.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 106.69 -1.596 . . . . 72.35 106.69 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -112.25 130.88 55.78 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.843 -1.169 . . . . 73.22 107.843 178.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.1 m -111.01 112.58 24.5 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.469 -0.567 . . . . 71.42 109.469 -175.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -97.62 139.67 33.17 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 123.396 0.678 . . . . 73.11 109.95 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 64.5 p -84.65 150.79 24.9 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.765 0.826 . . . . 75.53 110.223 -176.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 54.4 p -126.66 145.85 54.8 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.589 0.756 . . . . 63.14 109.587 -174.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -52.74 -41.08 71.99 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 123.203 2.602 . . . . 73.33 113.246 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -73.53 111.9 9.1 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.2 0.6 . . . . 60.44 109.858 172.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -71.99 -16.99 62.08 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.239 1.016 . . . . 74.03 112.368 -172.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -89.73 6.75 40.13 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.737 0.815 . . . . 63.32 111.5 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -135.47 159.34 41.9 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.391 1.077 . . . . 63.22 109.353 174.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.9 tp -156.86 127.55 6.66 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.314 -0.625 . . . . 74.52 109.314 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.54 114.7 26.97 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.367 0.667 . . . . 73.04 111.258 -173.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -103.19 125.35 49.83 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.748 1.219 . . . . 74.51 108.2 170.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.5 tp -130.71 136.69 49.02 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.501 0.72 . . . . 75.41 109.34 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.4 m -91.05 112.41 24.3 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.77 -0.826 . . . . 72.51 108.77 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.2 p -75.9 -5.74 47.56 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.249 0.62 . . . . 73.12 112.423 -174.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -71.0 -31.26 67.74 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.174 0.59 . . . . 65.43 110.141 169.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.96 36.28 3.23 Favored Glycine 0 C--N 1.344 1.01 0 CA-C-N 115.475 -0.784 . . . . 72.54 111.986 -174.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -83.71 81.87 8.57 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.545 0.688 . . . . 74.33 109.449 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.41 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 52.2 ttm -74.67 133.14 42.13 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 114.97 -1.013 . . . . 72.24 109.871 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.534 HD11 ' HB2' ' A' ' 84' ' ' LEU . 75.4 mt -78.12 -57.67 3.66 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.238 0.615 . . . . 72.52 110.494 -174.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.515 ' HB2' ' HA ' ' A' ' 81' ' ' ASP . 10.1 mm100 . . . . . 0 CA--C 1.554 1.112 0 C-N-CA 124.387 1.075 . . . . 75.04 109.143 -177.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 73.7 m . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 120.978 0.418 . . . . 73.53 111.779 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.2 mmpt? -87.82 154.07 20.84 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.103 0.961 . . . . 73.54 110.329 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.4 m -77.65 91.9 4.06 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.571 0.748 . . . . 75.13 109.63 177.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.444 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 64.5 mt -73.47 109.15 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.311 1.044 . . . . 74.11 109.678 -175.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.2 t -87.04 110.06 19.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 109.225 -0.657 . . . . 74.24 109.225 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 76.0 mt -106.61 107.83 23.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 107.556 -1.275 . . . . 65.41 107.556 174.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -92.37 165.26 13.16 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 109.68 -0.489 . . . . 74.3 109.68 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -64.79 -24.46 67.56 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.507 0.723 . . . . 75.41 111.759 178.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.0 t -79.48 -22.88 43.47 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.403 0.681 . . . . 74.24 110.672 176.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -90.16 63.18 5.73 Favored 'General case' 0 C--N 1.354 0.771 0 C-N-CA 123.604 0.762 . . . . 64.45 109.894 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.477 ' HA ' HD11 ' A' ' 58' ' ' ILE . 38.1 tt0 -65.45 -23.82 67.02 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.897 -0.592 . . . . 75.35 110.466 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -61.67 -40.65 95.7 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.092 0.957 . . . . 62.31 111.278 175.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.0 mt -71.86 -41.38 68.16 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.273 0.629 . . . . 74.1 110.007 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 55' ' ' GLU . 79.9 mt -59.2 -37.76 70.48 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 124.356 1.062 . . . . 73.12 111.103 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -58.47 -34.43 70.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.48 0.712 . . . . 74.25 111.699 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 53.0 m80 -94.95 13.71 24.07 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.031 0.932 . . . . 75.44 111.525 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.4 m -138.4 96.51 3.18 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.726 0.81 . . . . 72.4 109.793 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -55.73 -44.89 77.94 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.549 1.139 . . . . 74.51 112.388 -177.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.538 ' HB3' HG23 ' A' ' 115' ' ' VAL . 51.1 tp -61.1 -39.52 90.26 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.355 -0.839 . . . . 75.35 111.464 177.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.65 -43.52 96.52 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.906 0.483 . . . . 73.03 111.396 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -56.29 -47.56 78.41 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 123.993 0.808 . . . . 75.33 110.612 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.513 ' HB3' HD22 ' A' ' 104' ' ' LEU . 27.2 mm-40 -62.14 -44.98 95.43 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.754 0.822 . . . . 74.13 113.09 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.408 HG23 HD22 ' A' ' 77' ' ' LEU . 81.3 mt -65.13 -49.93 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.255 0.622 . . . . 75.21 110.863 -177.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -69.56 -26.21 64.38 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 111.988 0.366 . . . . 74.1 111.988 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.8 tp -72.5 -60.09 2.4 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 122.993 0.517 . . . . 74.52 111.268 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -81.35 -21.57 39.03 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.765 -0.652 . . . . 70.22 111.398 -171.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.509 ' SG ' HG21 ' A' ' 97' ' ' ILE . 60.1 m -124.44 92.73 47.6 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 123.612 0.765 . . . . 74.24 109.472 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.03 -10.75 26.51 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 123.004 2.47 . . . . 73.13 113.337 -177.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.418 ' HA3' HG13 ' A' ' 92' ' ' VAL . . . -100.6 46.63 1.32 Allowed Glycine 0 C--N 1.348 1.244 0 C-N-CA 122.759 0.219 . . . . 32.21 112.721 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 94.8 t -122.26 125.34 72.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 123.742 0.817 . . . . 74.32 109.187 170.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -87.82 -42.43 12.56 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.76 0.424 . . . . 75.15 111.158 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.1 t -152.98 165.51 35.33 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.061 0.458 . . . . 73.34 111.272 -172.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.408 HD22 HG23 ' A' ' 67' ' ' ILE . 79.1 mt -128.62 130.02 46.7 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 124.61 1.164 . . . . 75.11 108.143 175.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.525 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.7 ttm -107.72 101.88 11.15 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.53 -1.285 . . . . 73.24 107.53 174.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.444 ' HB ' ' HB ' ' A' ' 48' ' ' ILE . 45.8 mm -83.55 100.69 7.31 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 108.221 -1.029 . . . . 72.44 108.221 -176.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -83.06 172.06 51.09 Favored Glycine 0 C--O 1.248 0.973 0 N-CA-C 109.715 -1.354 . . . . 75.23 109.715 174.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.515 ' HA ' ' HB2' ' A' ' 41' ' ' GLN . 10.9 p-10 -70.07 -51.76 29.29 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 110.122 -0.325 . . . . 74.11 110.122 -178.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -99.58 -39.82 8.12 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.229 0.612 . . . . 74.21 109.847 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -95.76 163.03 13.35 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.522 0.729 . . . . 74.35 111.67 -170.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.534 ' HB2' HD11 ' A' ' 40' ' ' LEU . 67.3 tp -130.03 113.42 14.53 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.747 -0.834 . . . . 73.24 108.747 175.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.525 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 51.3 m -105.69 109.93 22.06 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.207 -0.664 . . . . 64.22 109.207 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.9 mm -87.83 133.76 29.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 107.77 -1.196 . . . . 74.31 107.77 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -114.44 134.0 55.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.417 0.687 . . . . 72.02 109.32 -177.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.497 ' NZ ' HD12 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -140.07 174.6 10.35 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.432 0.634 . . . . 75.02 111.426 175.285 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -86.49 147.73 25.85 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.917 -1.038 . . . . 70.03 109.08 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.6 ptt180 -76.81 -1.94 30.75 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 112.826 0.676 . . . . 75.21 112.826 -173.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 66.9 mtt -79.35 -24.49 42.68 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 109.854 -0.424 . . . . 74.33 109.854 172.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.418 HG13 ' HA3' ' A' ' 73' ' ' GLY . 60.1 t -98.29 142.27 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.909 0.883 . . . . 64.24 108.717 177.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -88.82 142.35 27.74 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.864 0.866 . . . . 74.31 111.556 -175.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.402 ' CD2' ' HE2' ' A' ' 88' ' ' LYS . 52.7 m95 -71.54 -45.37 62.51 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.967 0.507 . . . . 73.31 111.064 172.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -50.44 -32.21 17.22 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 124.56 1.144 . . . . 74.32 112.572 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.4 m -73.97 -54.32 8.16 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-N 115.467 -0.788 . . . . 75.04 110.839 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.509 HG21 ' SG ' ' A' ' 71' ' ' CYS . 10.5 mt -81.33 -22.4 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 124.318 1.047 . . . . 75.14 112.376 -170.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.69 -50.57 84.7 Favored Pre-proline 0 CA--C 1.557 1.246 0 C-N-CA 124.316 1.046 . . . . 74.41 113.512 -168.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -62.3 -28.44 78.85 Favored 'Trans proline' 0 C--N 1.385 2.49 0 C-N-CA 121.564 1.509 . . . . 65.33 111.97 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -70.68 -40.31 73.02 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.973 0.909 . . . . 74.21 111.219 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 71.4 mt -68.99 -45.9 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 N-CA-C 109.811 -0.44 . . . . 73.45 109.811 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.449 HG21 ' HB ' ' A' ' 19' ' ' ILE . 88.4 mt -53.57 -40.63 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.585 0.754 . . . . 74.02 110.597 175.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -74.37 -37.57 63.41 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.523 -0.762 . . . . 52.35 111.505 -179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.513 HD22 ' HB3' ' A' ' 66' ' ' GLN . 48.8 mt -64.75 -33.43 75.96 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.662 0.785 . . . . 64.31 111.6 175.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.36 -25.03 62.2 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.716 -0.675 . . . . 74.34 110.275 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 26.0 m -79.85 -33.76 39.91 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 109.05 -0.722 . . . . 65.33 109.05 176.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -64.67 -50.57 66.52 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.285 0.634 . . . . 75.23 111.08 175.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.51 ' HG3' ' HB2' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -68.16 -56.13 9.87 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.98 0.912 . . . . 75.25 110.431 -173.216 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 113' ' ' GLU . 66.9 mt -67.76 -11.96 59.54 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.679 0.792 . . . . 73.3 112.527 -173.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.07 -39.59 93.44 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.263 0.625 . . . . 65.4 110.386 173.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -94.26 -37.7 11.39 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.488 -0.778 . . . . 73.23 110.516 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.55 160.33 26.92 Favored Glycine 0 C--N 1.349 1.295 0 N-CA-C 114.243 0.457 . . . . 61.11 114.243 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.467 ' HA ' HD22 ' A' ' 109' ' ' LEU . 0.2 OUTLIER -86.29 -16.98 35.82 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.429 1.092 . . . . 74.33 111.604 179.904 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -67.3 107.95 2.57 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.345 0.658 . . . . 73.35 111.262 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.538 HG23 ' HB3' ' A' ' 63' ' ' LEU . 2.9 p . . . . . 0 CA--C 1.555 1.153 0 CA-C-N 115.459 -0.791 . . . . 74.2 109.91 170.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.556 HG21 ' HB2' ' A' ' 109' ' ' LEU . 1.6 mp . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 107.328 -1.36 . . . . 73.35 107.328 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -67.65 131.73 46.15 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.284 -0.871 . . . . 74.22 109.224 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.541 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.7 mm -112.78 124.9 69.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 N-CA-C 105.975 -1.861 . . . . 70.3 105.975 -178.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HD3' HD22 ' A' ' 33' ' ' LEU . 51.3 tttp -90.75 159.7 16.19 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.318 -1.364 . . . . 75.33 107.318 -179.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.493 HG23 ' HE3' ' A' ' 98' ' ' LYS . 41.2 m -137.83 133.17 33.63 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.893 -0.78 . . . . 75.52 108.893 176.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.532 HD11 HD23 ' A' ' 33' ' ' LEU . 50.6 mt -117.48 139.23 51.2 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 107.474 -1.306 . . . . 51.44 107.474 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 62.5 p -69.98 155.79 40.06 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 122.64 0.376 . . . . 71.04 110.296 175.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.0 p -131.35 149.53 73.86 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 124.31 1.044 . . . . 64.03 108.94 -177.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.3 -9.61 26.31 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 122.538 2.158 . . . . 74.52 113.308 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.402 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 7.9 t30 -101.02 128.33 47.1 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.42 0.688 . . . . 71.15 109.446 174.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -68.0 -35.87 79.04 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.544 1.137 . . . . 73.02 113.315 -175.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -78.43 -16.01 58.04 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.993 0.517 . . . . 73.42 111.111 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.434 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -102.23 151.44 22.21 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.823 0.849 . . . . 51.11 110.155 -178.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.9 tp -160.74 118.82 2.49 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 108.112 -1.07 . . . . 73.54 108.112 172.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -90.69 130.91 36.64 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 121.489 0.662 . . . . 71.31 110.531 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -104.13 119.62 39.35 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 107.249 -1.389 . . . . 74.52 107.249 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.532 HD23 HD11 ' A' ' 22' ' ' LEU . 23.6 tp -98.54 123.47 42.73 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.517 -0.92 . . . . 74.15 108.517 -172.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.4 m -90.53 105.78 18.05 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 108.47 -0.937 . . . . 74.44 108.47 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.5 t -136.83 8.06 3.0 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 115.745 -0.661 . . . . 75.42 111.416 -174.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -145.63 141.25 27.98 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.146 -1.057 . . . . 74.32 108.146 175.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . 0.542 ' HA3' HG13 ' A' ' 17' ' ' ILE . . . 81.91 -90.05 1.45 Allowed Glycine 0 C--N 1.34 0.79 0 N-CA-C 110.816 -0.914 . . . . 75.13 110.816 -173.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -134.26 -179.59 5.66 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.128 0.971 . . . . 63.31 109.958 178.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 12.3 ptp -111.88 162.14 15.62 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.128 0.971 . . . . 75.3 108.422 161.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.41 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 74.4 mt -70.66 -38.71 73.83 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.783 0.833 . . . . 74.3 111.731 -175.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.717 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.6 tt0 . . . . . 0 CA--C 1.542 0.664 0 N-CA-C 107.735 -1.209 . . . . 75.42 107.735 -178.161 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.6 t . . . . . 0 CA--C 1.554 1.109 0 N-CA-C 110.064 -0.347 . . . . 73.23 110.064 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.4 178.61 5.56 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.597 1.159 . . . . 73.32 111.513 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 55.2 m -91.79 128.91 37.8 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.892 0.877 . . . . 72.35 109.818 173.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 mp -96.74 119.52 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 124.197 0.999 . . . . 75.24 109.016 -178.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -91.49 110.33 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 CA-C-N 118.447 0.567 . . . . 73.32 109.786 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.1 mt -101.95 109.74 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.46 1.104 . . . . 74.4 108.81 176.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -93.12 151.05 20.09 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.214 0.606 . . . . 73.5 109.882 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.413 ' HA ' HD11 ' A' ' 58' ' ' ILE . 47.3 p30 -66.95 -24.32 66.06 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.387 0.675 . . . . 73.54 112.137 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.8 t -84.52 -7.07 59.39 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.975 0.91 . . . . 75.21 112.008 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -111.66 88.7 2.86 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.272 0.629 . . . . 73.24 109.795 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.44 -35.26 51.85 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.273 1.029 . . . . 75.21 111.653 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -57.3 -53.39 58.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.511 1.124 . . . . 74.24 111.094 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.8 -34.41 78.28 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.417 -0.81 . . . . 75.44 111.231 -176.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.489 HG23 ' HG2' ' A' ' 65' ' ' GLN . 66.6 mt -70.09 -47.33 68.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.188 0.995 . . . . 74.03 110.217 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -62.29 -19.33 63.15 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.473 1.109 . . . . 72.54 112.683 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -69.25 -54.86 12.56 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-O 121.334 0.587 . . . . 74.33 109.732 172.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.3 m -94.67 107.82 19.81 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.103 -0.953 . . . . 72.53 110.478 -172.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.427 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 38.7 ttpt -59.1 -33.27 70.63 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.018 0.527 . . . . 74.03 109.741 174.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 30.6 tp -59.23 -46.52 88.25 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.619 1.167 . . . . 75.3 110.637 177.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.09 -47.02 84.49 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 123.85 0.86 . . . . 71.41 110.658 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.489 ' HG2' HG23 ' A' ' 58' ' ' ILE . 65.9 mt-30 -59.1 -39.94 83.77 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 124.58 1.175 . . . . 74.21 110.967 -178.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.54 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 17.0 mm100 -66.73 -45.77 77.59 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 118.513 -0.756 . . . . 64.33 110.891 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -58.33 -43.61 86.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 CA-C-N 118.63 0.65 . . . . 72.05 110.68 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -68.58 -32.79 72.95 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.387 0.675 . . . . 74.41 111.342 175.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.6 tp -68.16 -34.8 76.99 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.439 0.696 . . . . 74.2 110.817 175.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.54 ' HG2' ' O ' ' A' ' 66' ' ' GLN . 7.1 mm100 -75.16 -41.31 58.4 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 120.983 0.421 . . . . 75.34 110.007 -178.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.44 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 61.0 m -151.43 100.57 2.97 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 124.136 0.974 . . . . 53.34 108.503 -176.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -67.25 1.95 2.61 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 123.381 2.721 . . . . 75.13 114.349 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.58 -5.42 89.92 Favored Glycine 0 C--N 1.352 1.457 0 CA-C-O 119.749 -0.473 . . . . 71.45 113.544 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.1 t -74.09 127.04 35.69 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 123.063 0.545 . . . . 74.45 110.243 177.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -84.79 -45.5 12.3 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.934 0.894 . . . . 73.13 110.874 -177.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.9 p -156.92 166.2 34.02 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.789 0.804 . . . . 74.44 110.923 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.1 mt -126.18 127.62 45.98 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 107.157 -1.423 . . . . 74.13 107.157 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.583 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.3 ttm -103.56 96.75 6.94 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 106.989 -1.485 . . . . 74.15 106.989 173.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 29.4 mm -77.88 101.01 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 114.893 -1.049 . . . . 74.02 108.685 -175.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.88 174.24 44.07 Favored Glycine 0 C--O 1.247 0.967 0 N-CA-C 110.31 -1.116 . . . . 64.14 110.31 176.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.717 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 2.5 m-20 -76.64 -56.67 4.4 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.791 0.805 . . . . 74.24 109.808 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -101.9 -7.79 22.15 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.474 -1.239 . . . . 65.13 111.114 -174.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -139.9 172.32 12.94 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.452 0.701 . . . . 74.55 110.654 -176.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.41 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 35.7 tp -143.75 106.93 4.52 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.872 0.469 . . . . 75.22 110.13 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.583 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 61.0 m -95.8 103.49 15.38 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.851 -0.796 . . . . 70.2 108.851 -176.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.612 HG13 HD13 ' A' ' 101' ' ' ILE . 15.7 mm -87.88 122.55 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.554 -0.906 . . . . 74.11 108.554 -177.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -108.35 113.57 26.75 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 108.153 -1.054 . . . . 74.13 108.153 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.74 177.55 5.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.45 0.7 . . . . 74.43 110.446 -175.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -77.16 136.85 38.61 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.184 0.593 . . . . 75.03 110.109 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -67.74 -22.18 65.24 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 112.86 0.689 . . . . 70.44 112.86 -171.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 71.8 mtm -79.81 -22.89 42.51 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.866 0.466 . . . . 71.23 110.888 176.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 38.5 t -89.56 141.72 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.028 -1.101 . . . . 73.54 108.028 176.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 68.7 m80 -110.9 157.24 20.09 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.612 0.597 . . . . 74.32 112.612 -171.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -70.74 -25.22 62.83 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.19 0.996 . . . . 71.24 112.93 -176.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -59.2 -24.87 63.48 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 120.977 0.417 . . . . 71.52 111.043 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 17.8 m -88.87 -42.29 11.94 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.283 1.033 . . . . 74.35 111.739 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.453 HG22 HD12 ' A' ' 101' ' ' ILE . 7.6 mt -91.33 -50.02 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 122.905 0.482 . . . . 72.34 111.039 -165.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.493 ' HE3' HG23 ' A' ' 21' ' ' THR . 85.8 tttt -50.95 -51.36 67.96 Favored Pre-proline 0 CA--C 1.566 1.561 0 N-CA-C 114.509 1.3 . . . . 74.31 114.509 -174.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -57.26 -35.15 98.85 Favored 'Trans proline' 0 C--N 1.398 3.143 0 C-N-CA 121.884 1.723 . . . . 74.23 112.147 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 26.0 mm-40 -67.53 -46.02 74.01 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.159 -0.928 . . . . 73.24 110.268 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.612 HD13 HG13 ' A' ' 86' ' ' ILE . 76.7 mt -61.53 -47.11 94.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.611 0.764 . . . . 74.42 110.565 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.541 HG23 ' HB ' ' A' ' 19' ' ' ILE . 76.8 mt -57.86 -45.55 87.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 123.659 0.599 . . . . 74.41 110.25 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -59.37 -48.0 83.3 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.851 0.86 . . . . 74.3 111.273 178.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 95.7 mt -62.88 -40.0 96.18 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.033 0.933 . . . . 74.13 111.726 -178.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -71.74 -27.9 63.31 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.758 0.823 . . . . 74.42 110.933 178.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 97.5 m -74.25 -47.01 37.89 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.922 0.489 . . . . 74.34 109.775 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -76.15 -34.6 59.4 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.399 -0.819 . . . . 73.32 111.357 -174.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.648 ' HG3' ' HB2' ' A' ' 113' ' ' GLU . 30.8 tt0 -59.31 -55.34 36.09 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.92 0.488 . . . . 70.34 109.997 175.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.556 ' HB2' HG21 ' A' ' 17' ' ' ILE . 80.9 mt -73.43 -16.95 61.3 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.299 -0.864 . . . . 71.31 111.119 -175.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.35 -46.3 70.51 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.347 0.659 . . . . 72.04 110.407 171.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.477 ' HB2' ' HG3' ' A' ' 113' ' ' GLU . 18.8 m-85 -73.79 -19.22 60.83 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 115.963 -0.562 . . . . 74.23 110.155 173.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.57 44.4 26.7 Favored Glycine 0 C--N 1.35 1.358 0 N-CA-C 111.584 -0.607 . . . . 74.34 111.584 -179.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.648 ' HB2' ' HG3' ' A' ' 108' ' ' GLN . 44.0 mt-10 -88.69 174.9 7.76 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.747 0.819 . . . . 55.32 111.25 -177.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -109.85 128.21 55.19 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 124.685 1.194 . . . . 73.41 108.928 -178.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.404 HG12 ' HB3' ' A' ' 40' ' ' LEU . 5.1 p . . . . . 0 CA--C 1.546 0.802 0 N-CA-C 107.591 -1.262 . . . . 72.45 107.591 165.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.404 ' O ' HG12 ' A' ' 19' ' ' ILE . 67.6 mt . . . . . 0 C--O 1.238 0.468 0 N-CA-C 107.357 -1.349 . . . . 74.51 107.357 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -67.51 105.42 1.83 Allowed 'General case' 0 C--O 1.241 0.644 0 CA-C-O 121.494 0.664 . . . . 75.32 110.25 -171.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 17' ' ' ILE . 49.8 mm -118.79 109.95 28.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 N-CA-C 106.378 -1.712 . . . . 74.2 106.378 -176.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -92.87 119.48 32.23 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 108.678 -0.86 . . . . 74.51 108.678 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.9 t -92.55 118.79 31.37 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.734 -0.839 . . . . 65.04 108.734 -178.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.4 mt -124.58 140.7 52.7 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.331 1.052 . . . . 73.34 109.19 -173.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 17.9 p -82.09 152.96 26.33 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 122.77 0.428 . . . . 70.4 110.595 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.7 p -114.4 169.94 6.01 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.119 0.968 . . . . 75.15 108.645 -178.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -59.63 -12.22 16.92 Favored 'Trans proline' 0 C--N 1.381 2.252 0 C-N-CA 122.487 2.124 . . . . 74.44 113.598 168.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.469 ' HB2' ' HB1' ' A' ' 29' ' ' ALA . 84.0 m-20 -95.0 151.49 19.12 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.203 1.001 . . . . 71.41 110.701 176.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -82.86 -45.26 14.46 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.265 0.626 . . . . 71.14 109.966 174.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -92.52 29.95 1.62 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.067 0.947 . . . . 72.11 111.048 -174.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.469 ' HB1' ' HB2' ' A' ' 26' ' ' ASN . . . -139.45 127.6 22.49 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.9 0.88 . . . . 74.53 108.769 171.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.9 tp -129.1 125.64 37.61 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.869 -1.159 . . . . 71.22 107.869 174.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -82.62 133.05 35.18 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.094 0.958 . . . . 73.51 110.588 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -117.01 122.96 45.71 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 107.885 -1.154 . . . . 73.21 107.885 171.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.7 tp -118.31 130.56 56.1 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.422 0.689 . . . . 73.0 111.099 -169.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 p -90.11 120.95 31.73 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 108.538 -0.912 . . . . 73.24 108.538 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 60.0 p -108.9 -26.95 9.97 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 113.669 0.988 . . . . 75.21 113.669 -164.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -72.32 -37.65 68.86 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 118.113 0.415 . . . . 74.41 110.599 -175.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 157.18 1.24 0.1 OUTLIER Glycine 0 C--N 1.345 1.037 0 CA-C-O 119.514 -0.604 . . . . 61.14 114.218 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.5 ' HB3' HD23 ' A' ' 109' ' ' LEU . 18.6 mp0 -79.77 84.84 5.51 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.365 0.666 . . . . 74.3 110.879 -171.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 79.7 mtp -77.72 124.81 28.43 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.118 0.485 . . . . 75.01 110.457 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.523 ' HB3' HG12 ' A' ' 115' ' ' VAL . 95.6 mt -65.64 -33.23 75.41 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 125.142 1.377 . . . . 74.13 112.209 -177.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.571 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 29.1 tt0 . . . . . 0 CA--C 1.544 0.728 0 C-N-CA 124.81 1.244 . . . . 74.11 107.76 -174.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 63.8 m . . . . . 0 CA--C 1.539 0.549 0 N-CA-C 109.157 -0.682 . . . . 63.3 109.157 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -62.12 145.88 52.08 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.014 0.526 . . . . 74.33 111.665 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.1 m -63.05 113.09 2.91 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.107 0.963 . . . . 73.21 111.441 -174.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.6 mt -80.85 116.1 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 123.607 0.763 . . . . 70.22 110.365 -174.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 64.4 t -91.55 108.26 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 N-CA-C 109.082 -0.71 . . . . 71.1 109.082 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.419 ' HB ' ' HB2' ' A' ' 77' ' ' LEU . 73.3 mt -96.45 110.28 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 108.066 -1.087 . . . . 75.32 108.066 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.419 ' HB2' ' HZ1' ' A' ' 51' ' ' LYS . 10.4 mtmp? -92.52 161.66 14.53 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.869 0.467 . . . . 74.05 110.279 -179.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.9 p30 -65.58 -25.82 67.57 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 113.736 1.013 . . . . 74.11 113.736 -175.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.0 p -84.9 -12.1 54.15 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.384 0.274 . . . . 64.23 111.462 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -82.89 68.97 9.59 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.32 0.648 . . . . 73.45 110.043 -177.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -49.26 -39.33 30.09 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.504 1.522 . . . . 71.22 111.648 176.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 39.6 t-20 -60.23 -50.13 74.89 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.568 1.147 . . . . 71.32 110.568 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 71.2 mt -74.73 -28.93 60.99 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.855 0.462 . . . . 70.34 111.559 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 82.8 mt -67.14 -49.2 75.19 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 N-CA-C 109.224 -0.658 . . . . 62.32 109.224 174.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -66.54 -24.42 66.37 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.121 0.415 . . . . 74.42 112.121 177.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -79.77 -24.74 41.31 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 112.022 0.379 . . . . 64.2 112.022 175.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.9 t -114.97 108.52 16.81 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 109.747 -0.464 . . . . 73.43 109.747 177.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -64.54 -31.64 72.94 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.057 0.543 . . . . 63.15 110.778 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.518 ' HB2' ' NE2' ' A' ' 108' ' ' GLN . 58.6 tp -60.74 -41.63 95.77 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.517 0.727 . . . . 72.13 110.599 173.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -57.65 -47.39 82.4 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.837 0.455 . . . . 71.44 110.459 177.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -59.17 -44.77 92.16 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.077 -0.965 . . . . 73.35 110.571 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -59.75 -53.33 59.22 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.811 0.844 . . . . 74.33 112.488 177.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.568 HG23 HG21 ' A' ' 74' ' ' VAL . 59.6 mt -65.51 -39.82 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 123.084 0.554 . . . . 74.31 111.143 -174.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -66.78 -31.03 71.4 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.337 0.655 . . . . 74.14 111.51 174.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.3 tp -70.85 -52.78 18.22 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.872 0.469 . . . . 75.51 110.744 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -69.79 -29.23 66.49 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.321 -0.854 . . . . 74.21 110.894 -174.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.619 ' SG ' HG23 ' A' ' 97' ' ' ILE . 82.3 m -144.61 96.33 5.2 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 108.884 -0.784 . . . . 71.03 108.884 176.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -63.87 -4.57 7.54 Favored 'Trans proline' 0 N--CA 1.5 1.911 0 C-N-CA 123.276 2.651 . . . . 73.24 114.315 175.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.487 ' HA3' HG22 ' A' ' 92' ' ' VAL . . . -86.99 8.64 75.56 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-O 119.555 -0.581 . . . . 70.23 113.794 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.568 HG21 HG23 ' A' ' 67' ' ' ILE . 99.9 t -69.79 124.74 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.192 0.597 . . . . 64.31 110.073 173.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.05 -56.6 3.39 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.905 -0.776 . . . . 72.5 108.905 -179.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 61.1 m -147.74 167.92 23.43 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 115.768 -0.651 . . . . 61.32 110.891 -178.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.419 ' HB2' ' HB ' ' A' ' 50' ' ' ILE . 77.3 mt -127.16 148.54 50.17 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.535 1.134 . . . . 75.01 109.097 176.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.529 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.0 ttm -126.17 111.02 14.13 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 108.051 -1.092 . . . . 70.02 108.051 169.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.0 mm -89.35 103.01 13.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 108.37 -0.974 . . . . 74.45 108.37 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.9 176.81 41.22 Favored Glycine 0 C--O 1.243 0.671 0 N-CA-C 111.5 -0.64 . . . . 75.14 111.5 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.571 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 3.9 m-20 -69.96 -60.28 2.4 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.737 0.779 . . . . 63.23 109.611 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.23 -17.28 14.52 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.82 -1.082 . . . . 73.45 110.302 -177.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -118.63 167.99 11.12 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.363 0.665 . . . . 73.03 111.556 -171.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 31.8 tp -141.3 142.59 33.85 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.512 0.725 . . . . 75.44 109.326 175.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.529 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 86.8 m -131.03 118.15 20.17 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.289 0.636 . . . . 73.22 109.685 174.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.501 HG21 ' HZ2' ' A' ' 88' ' ' LYS . 19.7 mm -108.77 108.17 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 109.922 -0.399 . . . . 63.25 109.922 -177.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -83.15 146.62 28.54 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.382 0.673 . . . . 71.21 110.53 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.744 ' HE2' HG22 ' A' ' 97' ' ' ILE . 34.6 mmtm -123.51 171.59 9.39 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.893 0.877 . . . . 72.01 110.322 173.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.65 149.13 32.94 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.891 -1.151 . . . . 75.44 107.891 163.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -62.79 -24.44 67.74 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.432 0.693 . . . . 74.04 112.599 -175.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 21.5 ptm -73.13 -18.79 61.25 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.059 0.544 . . . . 72.52 111.822 -177.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.487 HG22 ' HA3' ' A' ' 73' ' ' GLY . 8.5 t -100.98 137.14 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.64 0.776 . . . . 71.43 109.811 -175.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -97.76 148.52 23.28 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.541 0.736 . . . . 73.14 111.733 -174.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -74.41 -36.43 63.47 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.941 1.296 . . . . 75.53 113.306 -173.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -52.57 -29.04 23.58 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.333 1.053 . . . . 63.45 113.241 -173.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.7 p -83.07 -36.51 24.84 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.399 0.68 . . . . 74.33 110.676 -178.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.744 HG22 ' HE2' ' A' ' 88' ' ' LYS . 48.2 mt -89.6 -29.53 5.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 CA-C-N 115.118 -0.946 . . . . 73.43 112.196 -164.198 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -53.3 -53.43 56.23 Favored Pre-proline 0 CA--C 1.562 1.426 0 CA-C-O 117.766 -1.111 . . . . 75.31 112.546 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.87 -31.94 94.56 Favored 'Trans proline' 0 C--N 1.395 3.015 0 C-N-CA 121.927 1.752 . . . . 72.45 112.51 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -64.01 -52.75 58.06 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.37 0.419 . . . . 71.44 111.272 177.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 67.5 mt -66.58 -43.7 90.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 122.989 0.515 . . . . 73.45 110.828 -176.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 93.5 mt -58.54 -40.41 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 122.89 0.476 . . . . 71.01 110.49 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.17 -46.99 75.45 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 123.326 0.391 . . . . 71.43 111.046 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.1 mt -62.31 -34.88 77.46 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.526 0.73 . . . . 75.35 111.469 -179.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.66 -35.43 70.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.46 0.704 . . . . 72.31 110.555 175.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 92.3 m -72.9 -32.75 65.57 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.638 -0.504 . . . . 74.24 109.638 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -66.7 -57.2 7.62 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.573 0.749 . . . . 75.2 110.129 174.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.518 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 26.2 tt0 -53.28 -55.58 23.5 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.062 0.945 . . . . 75.42 111.637 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.5 HD23 ' HB3' ' A' ' 38' ' ' GLU . 76.8 mt -68.87 -15.85 63.61 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 124.162 0.914 . . . . 74.35 111.609 -174.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -80.34 -20.44 44.19 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.292 0.637 . . . . 54.22 111.628 175.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -100.93 -28.19 12.89 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.217 0.607 . . . . 74.02 110.664 175.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.14 140.96 3.66 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.898 -0.592 . . . . 72.11 111.805 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -59.69 -33.83 72.1 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.898 0.879 . . . . 75.13 111.857 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -75.77 133.52 40.68 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.344 0.592 . . . . 74.54 111.822 -173.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.523 HG12 ' HB3' ' A' ' 40' ' ' LEU . 3.1 p . . . . . 0 N--CA 1.467 0.403 0 N-CA-C 107.889 -1.152 . . . . 63.55 107.889 158.078 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.518 ' HB ' HG21 ' A' ' 106' ' ' THR . 93.0 mt . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 109.745 -0.465 . . . . 74.43 109.745 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -84.67 135.46 34.15 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.1 0.56 . . . . 63.2 110.028 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.537 ' HB ' HG22 ' A' ' 102' ' ' ILE . 47.7 mm -128.78 122.23 56.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 107.522 -1.288 . . . . 73.21 107.522 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -101.6 125.44 48.26 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.288 1.035 . . . . 74.14 108.629 -176.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' THR . . . . . 0.5 HG22 ' HE3' ' A' ' 98' ' ' LYS . 28.8 m -105.53 111.22 23.84 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.594 -0.891 . . . . 64.43 108.594 -179.189 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.0 mt -100.43 139.35 36.23 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.966 0.906 . . . . 75.0 111.112 -174.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.2 p -70.48 130.4 41.77 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 124.372 1.045 . . . . 73.43 110.165 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 43.5 p -118.21 152.76 51.03 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 123.177 0.591 . . . . 73.01 110.185 -174.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.86 8.33 3.49 Favored 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 122.911 2.407 . . . . 74.24 112.615 172.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -90.42 123.57 34.25 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.333 1.053 . . . . 73.42 109.073 -178.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . 0.463 ' HG2' HD21 ' A' ' 28' ' ' ASN . 45.5 tt0 -77.87 130.77 37.04 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.399 0.68 . . . . 74.24 110.731 -177.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.463 HD21 ' HG2' ' A' ' 27' ' ' GLU . 51.2 m-80 59.1 25.11 13.51 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.637 1.175 . . . . 75.31 112.263 -173.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.501 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -142.02 139.48 32.37 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.382 0.673 . . . . 72.11 109.686 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.4 tp -148.34 138.04 22.25 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.733 0.413 . . . . 73.53 110.555 -173.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -85.9 123.78 31.63 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.374 0.669 . . . . 75.44 111.814 -174.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -110.34 110.6 21.45 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 107.174 -1.417 . . . . 70.3 107.174 170.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.3 tp -106.08 129.62 54.14 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.331 1.052 . . . . 72.33 110.24 -167.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.9 m -77.51 104.99 8.36 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.995 -0.743 . . . . 72.12 108.995 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.5 p -113.09 10.56 18.73 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.552 0.741 . . . . 65.42 111.278 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -75.34 -26.7 58.8 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.379 0.672 . . . . 75.44 110.902 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.71 -36.96 1.92 Allowed Glycine 0 C--N 1.334 0.419 0 N-CA-C 110.395 -1.082 . . . . 75.33 110.395 -176.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -78.2 161.41 27.34 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 122.026 0.917 . . . . 74.3 111.446 174.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.435 ' HE3' ' HB3' ' A' ' 82' ' ' ASP . 85.0 mtp -117.97 142.53 47.26 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 106.376 -1.713 . . . . 71.33 106.376 170.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 82.5 mt -55.29 -45.22 76.24 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.842 0.457 . . . . 72.43 112.021 -175.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 . . . . . 0 C--O 1.243 0.737 0 C-N-CA 124.333 1.053 . . . . 75.25 108.789 -177.025 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 121.27 0.557 . . . . 75.4 111.009 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -120.05 178.02 4.77 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 108.115 -1.069 . . . . 74.04 108.115 168.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.1 p -87.87 71.8 9.44 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.603 -1.258 . . . . 64.34 107.603 167.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.559 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 55.9 mt -72.42 104.49 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 115.323 -0.853 . . . . 71.35 109.817 -167.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 77' ' ' LEU . 60.2 t -87.63 109.59 19.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.806 -0.813 . . . . 75.54 108.806 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.432 HG22 ' HB2' ' A' ' 57' ' ' LEU . 52.5 mt -109.41 112.37 40.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 108.674 -0.862 . . . . 74.03 108.674 178.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.5 mtpt -86.47 162.01 18.31 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 109.39 -0.596 . . . . 75.23 109.39 173.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.8 p-10 -59.06 -24.75 63.15 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.41 1.084 . . . . 72.24 112.332 178.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.1 t -81.63 -18.23 45.39 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.073 0.549 . . . . 65.41 111.196 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.0 68.28 7.23 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.971 0.908 . . . . 73.22 111.115 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -60.02 -27.27 66.76 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.453 0.701 . . . . 73.41 110.994 176.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -60.37 -40.21 90.02 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 122.927 0.491 . . . . 74.32 111.355 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.432 ' HB2' HG22 ' A' ' 50' ' ' ILE . 87.1 mt -81.24 -35.7 30.88 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.808 0.843 . . . . 73.53 111.748 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 83.0 mt -63.22 -35.09 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.771 0.828 . . . . 75.11 109.836 176.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -63.02 -28.1 69.87 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.755 1.222 . . . . 64.21 111.663 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -82.02 -7.35 59.61 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.48 0.712 . . . . 72.31 111.926 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.2 t -135.74 101.77 4.87 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.895 0.478 . . . . 73.33 111.013 -171.08 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -54.76 -36.32 64.73 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.241 0.616 . . . . 70.35 110.648 170.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.557 ' HB2' ' HG3' ' A' ' 108' ' ' GLN . 27.2 tp -63.61 -44.08 95.0 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.261 0.624 . . . . 73.02 111.155 177.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.03 98.07 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.901 0.48 . . . . 72.32 111.099 179.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -54.43 -48.41 71.69 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 124.144 0.902 . . . . 74.04 110.475 175.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.512 ' HB3' HD23 ' A' ' 104' ' ' LEU . 27.9 mm-40 -63.68 -41.08 98.2 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.167 0.987 . . . . 75.45 113.101 178.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.508 HG21 HD21 ' A' ' 77' ' ' LEU . 95.9 mt -64.68 -53.22 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.472 0.709 . . . . 72.34 111.164 -178.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -68.49 -27.75 66.4 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 123.415 0.447 . . . . 73.04 111.416 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -66.55 -58.58 4.9 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.182 0.593 . . . . 73.45 110.739 177.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.46 ' NE2' HD21 ' A' ' 104' ' ' LEU . 78.7 mt-30 -79.21 -26.59 42.55 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.765 -0.652 . . . . 74.34 112.139 -174.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 79.5 m -133.08 86.85 41.29 Favored Pre-proline 0 CA--C 1.548 0.891 0 N-CA-C 108.904 -0.776 . . . . 72.23 108.904 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.88 -7.08 19.56 Favored 'Trans proline' 0 C--N 1.369 1.641 0 C-N-CA 122.933 2.422 . . . . 72.33 112.644 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.23 -15.28 81.71 Favored Glycine 0 C--N 1.347 1.19 0 CA-C-N 116.221 -0.445 . . . . 65.14 113.138 178.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 68.0 t -73.39 121.8 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 108.683 -0.858 . . . . 73.13 108.683 174.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -90.95 -28.67 17.9 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 115.9 -0.591 . . . . 74.14 110.904 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.7 t -161.65 161.63 29.63 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.591 0.71 . . . . 73.04 111.536 -171.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.508 HD21 HG21 ' A' ' 67' ' ' ILE . 84.6 mt -126.06 150.94 47.78 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.734 1.214 . . . . 75.1 108.228 177.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.557 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.3 ttm -125.01 104.15 8.4 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.028 -1.471 . . . . 73.21 107.028 168.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.697 HD13 HD12 ' A' ' 84' ' ' LEU . 34.2 mm -86.82 132.76 31.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.524 -0.917 . . . . 75.32 108.524 -175.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -121.14 -170.58 14.05 Favored Glycine 0 C--O 1.245 0.834 0 N-CA-C 110.901 -0.88 . . . . 74.43 110.901 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.02 -55.06 16.05 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.04 0.924 . . . . 74.53 109.707 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.435 ' HB3' ' HE3' ' A' ' 39' ' ' MET . 2.8 p-10 -118.03 0.98 11.96 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.513 -1.221 . . . . 74.41 111.705 -172.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -140.52 166.26 25.21 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.351 0.596 . . . . 73.44 111.661 -170.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.697 HD12 HD13 ' A' ' 79' ' ' ILE . 17.3 tp -141.65 116.56 9.86 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 114.368 -1.287 . . . . 72.11 108.601 176.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 14.1 m -100.61 111.56 23.82 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.261 -1.015 . . . . 74.01 108.261 179.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.501 ' O ' ' HA ' ' A' ' 29' ' ' ALA . 43.2 mm -86.31 125.88 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 109.244 -0.65 . . . . 73.52 109.244 -174.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -110.57 118.7 36.94 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 107.976 -1.12 . . . . 72.35 107.976 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -130.37 170.86 13.6 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 120.953 0.406 . . . . 74.31 111.205 -174.075 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 16.6 t70 -71.7 148.99 45.89 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 115.092 -0.958 . . . . 74.33 110.638 174.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 18.1 ptp180 -62.69 -24.11 67.48 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.309 1.044 . . . . 74.02 113.03 -175.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 86.8 mtp -80.11 -14.75 58.26 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.847 0.459 . . . . 74.1 111.784 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.84 124.09 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.543 0.737 . . . . 73.43 109.262 -175.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -89.18 142.47 27.62 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.489 0.716 . . . . 72.34 110.749 -172.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -58.81 -33.75 70.73 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.832 0.853 . . . . 75.51 112.442 178.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -61.62 -23.59 66.14 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.206 0.602 . . . . 75.25 112.277 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 26.5 m -91.61 -17.89 24.86 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.463 0.705 . . . . 74.25 111.849 177.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 87.1 mt -96.29 -50.8 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.894 0.878 . . . . 74.23 111.198 -171.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.5 ' HE3' HG22 ' A' ' 21' ' ' THR . 57.7 mtpt -56.15 -57.51 22.0 Favored Pre-proline 0 CA--C 1.551 0.988 0 CA-C-O 117.436 -1.269 . . . . 74.33 113.565 -167.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -59.59 -36.51 92.4 Favored 'Trans proline' 0 C--N 1.395 2.999 0 C-N-CA 121.978 1.786 . . . . 71.32 111.842 -174.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.471 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 6.3 mm-40 -66.59 -49.83 65.05 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 114.917 -1.038 . . . . 75.52 110.928 -177.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 24.4 mt -75.48 -29.88 21.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 C-N-CA 123.209 0.604 . . . . 70.23 111.502 -175.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.537 HG22 ' HB ' ' A' ' 19' ' ' ILE . 93.7 mt -60.2 -42.54 90.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-O 121.108 0.48 . . . . 74.32 109.795 170.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -63.63 -40.06 95.92 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 114.926 -1.034 . . . . 74.54 110.852 176.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.512 HD23 ' HB3' ' A' ' 66' ' ' GLN . 98.5 mt -66.57 -38.37 86.91 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.622 0.769 . . . . 73.23 112.53 178.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.608 HD13 HD21 ' A' ' 84' ' ' LEU . 10.0 mp -65.38 -24.24 67.17 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.621 0.369 . . . . 73.11 110.802 174.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.518 HG21 ' HB ' ' A' ' 17' ' ' ILE . 89.2 m -81.69 -37.16 27.82 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.569 0.747 . . . . 72.05 109.612 177.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -63.21 -46.62 86.17 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.436 0.695 . . . . 73.05 111.138 175.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.557 ' HG3' ' HB2' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -64.09 -56.97 11.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.002 0.921 . . . . 71.25 110.3 -175.027 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.473 ' HB2' HD12 ' A' ' 17' ' ' ILE . 97.1 mt -68.54 -12.63 61.54 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 115.761 -0.654 . . . . 73.22 112.279 -176.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -88.06 -49.54 6.97 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.863 0.465 . . . . 74.44 111.268 174.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -92.49 -16.53 25.68 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.649 0.379 . . . . 75.13 111.855 -170.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -134.13 -135.66 3.57 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 110.893 -0.883 . . . . 63.24 110.893 -178.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -160.85 -60.18 0.06 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.613 0.765 . . . . 72.42 110.071 -175.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -92.44 141.9 28.02 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.738 0.815 . . . . 43.43 110.087 -178.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.47 HG22 HD11 ' A' ' 79' ' ' ILE . 6.0 p . . . . . 0 C--O 1.215 -0.711 0 N-CA-C 108.573 -0.899 . . . . 64.14 108.573 168.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.6 mm . . . . . 0 N--CA 1.471 0.61 0 CA-C-O 119.589 -0.243 . . . . 74.33 110.557 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . 0.483 ' HB2' ' O ' ' A' ' 35' ' ' THR . 5.0 m170 -87.89 138.05 31.79 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 107.728 -1.212 . . . . 73.14 107.728 174.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.514 ' HB ' HG22 ' A' ' 102' ' ' ILE . 51.4 mm -123.06 116.45 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 107.848 -1.168 . . . . 62.5 107.848 -176.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.556 ' HE3' HD22 ' A' ' 22' ' ' LEU . 62.6 tttp -100.12 125.77 46.27 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.167 1.387 . . . . 75.23 108.955 -172.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 89.5 m -93.77 112.01 23.8 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.679 -0.86 . . . . 63.52 108.679 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.556 HD22 ' HE3' ' A' ' 20' ' ' LYS . 93.9 mt -106.31 136.59 45.77 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 123.737 0.815 . . . . 75.24 109.49 177.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 34.6 p -89.16 143.25 26.98 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.635 0.774 . . . . 71.42 110.405 179.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.7 p -119.98 154.24 55.42 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 124.377 1.071 . . . . 74.23 109.278 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -49.7 -45.97 29.27 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 123.571 2.847 . . . . 74.11 113.244 176.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -77.85 114.99 17.25 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.818 0.847 . . . . 71.25 109.145 175.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.38 -19.35 59.6 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.864 0.466 . . . . 63.43 111.436 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -63.42 -27.18 69.12 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.914 0.886 . . . . 74.44 109.612 172.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -102.37 154.06 19.43 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.056 1.342 . . . . 75.42 110.94 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 tp -151.07 127.82 10.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.683 0.793 . . . . 73.12 108.884 170.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -90.17 138.19 31.73 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.326 0.65 . . . . 74.24 111.729 -174.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -123.49 126.25 46.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.699 1.2 . . . . 74.13 108.638 171.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.6 tp -117.05 125.72 51.76 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.269 1.027 . . . . 73.41 108.656 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.4 p -80.59 107.07 13.09 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 108.848 -0.797 . . . . 71.12 108.848 176.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.483 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 26.0 p -106.87 127.43 53.41 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.009 1.324 . . . . 71.52 108.638 -177.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 57.99 73.79 0.45 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.349 1.06 . . . . 75.43 109.943 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -175.82 -130.05 1.28 Allowed Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 114.277 -1.328 . . . . 43.41 110.474 -176.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -129.4 156.26 44.36 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.818 0.847 . . . . 73.2 109.753 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 15.7 ttt -78.4 144.99 35.4 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.489 0.716 . . . . 64.21 110.776 -171.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.469 HD11 ' HB2' ' A' ' 84' ' ' LEU . 96.3 mt -70.73 -39.27 73.47 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.52 0.728 . . . . 73.2 112.2 -175.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.55 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.9 tp-100 . . . . . 0 CA--C 1.539 0.537 0 C-N-CA 123.949 0.899 . . . . 74.54 109.031 -176.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.7 m . . . . . 0 N--CA 1.477 0.916 0 CA-C-O 120.924 0.392 . . . . 63.25 111.678 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -94.99 -172.95 2.83 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.217 1.007 . . . . 75.03 109.881 175.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.6 p -72.56 101.26 2.95 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.542 0.737 . . . . 73.34 110.189 174.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 53.9 mt -78.51 102.53 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.445 0.698 . . . . 73.53 109.72 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 40.5 t -90.19 108.71 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 N-CA-C 109.036 -0.728 . . . . 54.45 109.036 -176.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 72.2 mt -98.36 109.14 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 N-CA-C 108.593 -0.891 . . . . 74.45 108.593 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -103.55 141.01 36.75 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.0 0.52 . . . . 75.2 110.007 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -62.37 -23.84 67.03 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.846 0.858 . . . . 54.44 112.842 -175.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.3 t -69.6 -35.62 75.48 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.35 0.66 . . . . 74.25 110.763 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -97.13 77.24 2.7 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 107.755 -1.202 . . . . 75.21 107.755 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.525 ' HA ' HD11 ' A' ' 58' ' ' ILE . 36.8 tt0 -66.34 -15.68 63.46 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.486 -0.779 . . . . 74.44 112.138 -172.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -63.35 -38.02 89.52 Favored 'General case' 0 C--N 1.35 0.623 0 N-CA-C 110.09 -0.337 . . . . 71.55 110.09 173.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.09 -36.43 84.27 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.593 0.757 . . . . 70.33 110.419 177.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.525 HD11 ' HA ' ' A' ' 55' ' ' GLU . 1.9 mp -61.73 -50.1 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 CA-C-N 115.063 -0.972 . . . . 63.11 109.026 173.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -65.87 -24.62 66.9 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.596 0.758 . . . . 64.14 112.016 -176.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 29.1 m170 -72.94 -39.07 66.54 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.795 0.438 . . . . 74.32 110.251 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.5 m -106.93 112.86 26.02 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.499 0.72 . . . . 74.24 111.614 -172.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -55.98 -39.09 71.3 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.201 0.6 . . . . 72.52 111.268 177.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.61 HD11 HD13 ' A' ' 105' ' ' LEU . 21.4 tp -61.62 -40.04 93.44 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 123.718 0.637 . . . . 70.12 111.065 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.422 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -65.94 -42.97 89.33 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.071 0.548 . . . . 74.03 111.003 179.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -55.89 -50.69 69.97 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.259 0.624 . . . . 75.44 109.947 176.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.498 ' HB3' HD23 ' A' ' 104' ' ' LEU . 26.7 mm-40 -59.31 -50.66 73.15 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.441 1.096 . . . . 73.43 112.613 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.0 mt -66.85 -51.28 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.354 0.662 . . . . 72.14 111.475 -174.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -67.18 -29.99 69.83 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.038 0.535 . . . . 74.52 111.827 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -70.07 -59.53 2.84 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-O 120.883 0.373 . . . . 72.23 110.814 176.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -82.75 -10.51 58.86 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.578 0.751 . . . . 74.41 111.984 -170.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.473 ' SG ' HG12 ' A' ' 97' ' ' ILE . 44.4 t -145.49 84.08 8.64 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 108.696 -0.853 . . . . 73.05 108.696 169.393 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -69.91 2.64 3.44 Favored 'Trans proline' 0 C--N 1.381 2.278 0 C-N-CA 123.195 2.597 . . . . 60.45 113.817 179.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . 0.49 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -84.39 -1.44 89.35 Favored Glycine 0 C--N 1.349 1.259 0 N-CA-C 114.168 0.427 . . . . 73.32 114.168 176.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.461 HG23 ' HG ' ' A' ' 71' ' ' CYS . 89.3 t -85.45 132.07 32.74 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 123.211 0.604 . . . . 72.14 109.443 174.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -84.01 -50.31 8.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.561 1.144 . . . . 75.15 110.875 176.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.8 p -155.02 155.5 34.27 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.61 -0.723 . . . . 73.12 110.955 -174.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 64' ' ' ALA . 36.3 mt -106.85 148.58 28.37 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.378 -1.341 . . . . 74.12 107.378 170.556 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.549 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 50.6 ttm -125.32 101.08 6.8 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 106.6 -1.63 . . . . 74.34 106.6 167.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.761 HG23 HG13 ' A' ' 115' ' ' VAL . 18.2 mm -81.01 107.44 13.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 107.921 -1.14 . . . . 74.32 107.921 -178.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.53 170.38 36.88 Favored Glycine 0 C--O 1.245 0.805 0 N-CA-C 109.689 -1.364 . . . . 61.42 109.689 171.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.55 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 6.9 p-10 -59.64 -51.41 69.94 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 123.854 0.384 . . . . 73.44 110.588 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -107.2 -30.46 8.74 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.01 0.524 . . . . 64.24 111.121 177.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -99.2 161.22 13.74 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.2 0.6 . . . . 75.12 111.876 -172.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.469 ' HB2' HD11 ' A' ' 40' ' ' LEU . 26.3 tp -134.24 112.04 10.74 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.747 0.819 . . . . 74.21 108.99 172.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.549 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 25.5 m -100.79 105.52 16.83 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.868 -0.79 . . . . 72.53 108.868 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.4 mm -88.26 124.97 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 108.787 -0.819 . . . . 74.22 108.787 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -110.31 123.77 50.44 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.193 -1.04 . . . . 72.41 108.193 177.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.454 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -117.52 178.33 4.43 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.051 0.54 . . . . 75.45 110.67 -173.199 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -92.33 155.41 17.94 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.536 0.734 . . . . 72.3 110.432 173.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -58.26 -35.43 71.74 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.603 1.161 . . . . 71.22 113.635 -173.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 79.3 mtp -76.69 -21.38 55.45 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.847 0.459 . . . . 71.33 111.85 -175.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.49 HG11 ' HA3' ' A' ' 73' ' ' GLY . 10.9 t -103.21 121.08 54.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 108.824 -0.806 . . . . 74.44 108.824 -173.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -101.61 150.88 22.64 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.042 0.937 . . . . 75.15 109.271 -171.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.454 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 85.6 m95 -59.52 -15.71 19.77 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.893 1.071 . . . . 75.5 113.893 -172.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -58.61 -39.24 79.88 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.698 0.799 . . . . 72.33 111.692 176.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.3 t -91.29 -12.99 33.48 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.666 0.787 . . . . 74.42 111.32 -176.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.473 HG12 ' SG ' ' A' ' 71' ' ' CYS . 59.6 mt -103.27 -54.79 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 C-N-CA 123.769 0.828 . . . . 74.02 111.253 -168.501 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -54.34 -54.19 50.96 Favored Pre-proline 0 CA--C 1.566 1.596 0 C-N-CA 124.78 1.232 . . . . 63.33 113.494 -171.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.29 -36.12 80.98 Favored 'Trans proline' 0 C--N 1.401 3.318 0 C-N-CA 122.237 1.958 . . . . 75.23 112.237 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.46 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 15.6 mm-40 -62.65 -48.66 78.38 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.579 -0.737 . . . . 72.24 110.085 178.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 50.9 mt -67.29 -41.79 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 123.395 0.678 . . . . 73.44 111.755 -177.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.514 HG22 ' HB ' ' A' ' 19' ' ' ILE . 57.9 mt -56.82 -41.25 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 123.112 0.565 . . . . 73.12 110.854 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -57.18 -52.13 66.54 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.46 0.704 . . . . 73.45 110.609 174.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.498 HD23 ' HB3' ' A' ' 66' ' ' GLN . 61.8 mt -64.04 -36.13 82.98 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.353 1.061 . . . . 62.32 112.316 -174.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.61 HD13 HD11 ' A' ' 63' ' ' LEU . 9.2 mp -69.88 -29.48 66.7 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.642 0.777 . . . . 64.24 111.028 177.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 50.3 m -78.14 -41.51 34.72 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.953 -0.758 . . . . 73.25 108.953 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -58.32 -56.86 16.57 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.337 1.055 . . . . 73.32 111.218 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.489 ' OE1' ' HB2' ' A' ' 63' ' ' LEU . 28.9 tt0 -58.04 -50.32 73.83 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.72 0.808 . . . . 75.03 111.585 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.4 mt -77.58 -18.07 57.23 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 115.049 -0.978 . . . . 64.12 111.639 -175.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.36 -42.57 71.64 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 122.746 0.419 . . . . 73.22 110.401 173.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -72.9 -19.33 61.29 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.858 -0.61 . . . . 74.32 110.361 172.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.81 59.58 2.77 Favored Glycine 0 C--N 1.344 1.022 0 CA-C-N 115.729 -0.669 . . . . 53.21 112.413 173.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -137.12 157.27 47.07 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 123.12 0.568 . . . . 73.2 110.119 177.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -80.68 160.46 24.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.803 1.241 . . . . 73.43 110.177 177.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.761 HG13 HG23 ' A' ' 79' ' ' ILE . 2.1 p . . . . . 0 N--CA 1.479 0.991 0 C-N-CA 124.521 1.129 . . . . 75.34 112.478 178.304 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.406 ' HB ' HG23 ' A' ' 106' ' ' THR . 72.9 mt . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 120.503 0.192 . . . . 74.43 110.816 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.88 121.93 16.17 Favored 'General case' 0 C--O 1.242 0.666 0 O-C-N 123.902 0.751 . . . . 73.2 109.982 172.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 47.6 mm -127.16 116.59 44.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 105.915 -1.883 . . . . 73.42 105.915 172.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -101.69 151.75 21.66 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.83 -1.174 . . . . 71.04 107.83 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.8 m -122.7 112.61 18.15 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.202 -0.666 . . . . 74.13 109.202 175.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.7 mt -86.72 139.46 30.72 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.701 0.8 . . . . 60.13 110.086 176.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -78.77 144.7 34.91 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.525 0.73 . . . . 73.43 109.344 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.9 p -122.98 162.68 37.8 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 124.332 1.053 . . . . 74.41 109.667 -174.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -75.81 43.77 1.16 Allowed 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 123.008 2.472 . . . . 74.33 112.448 171.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -155.79 138.47 15.15 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.763 -0.829 . . . . 74.54 108.763 -176.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -81.39 -43.12 19.44 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.545 0.738 . . . . 71.42 110.876 178.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -67.53 -45.42 75.79 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.894 0.877 . . . . 73.44 110.31 -178.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.55 132.19 35.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.41 0.684 . . . . 60.41 110.907 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 tp -135.49 128.9 32.26 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 108.382 -0.97 . . . . 73.34 108.382 172.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -93.11 118.2 30.94 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.437 0.695 . . . . 63.44 111.5 -171.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -103.39 116.69 32.9 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.306 1.042 . . . . 75.53 108.25 172.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.7 tp -104.18 127.65 51.81 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.639 0.776 . . . . 71.13 110.088 -178.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.4 t -83.69 115.95 22.42 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.749 -0.834 . . . . 75.32 108.749 174.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 71.4 p -107.47 -43.46 4.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 122.825 0.45 . . . . 73.33 112.02 -171.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -102.1 -24.95 13.89 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 112.575 0.583 . . . . 75.33 112.575 -174.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.75 -140.51 3.18 Favored Glycine 0 C--N 1.34 0.795 0 C-N-CA 121.603 -0.332 . . . . 74.12 112.504 -175.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.511 ' HB2' HD23 ' A' ' 109' ' ' LEU . 41.0 mt-10 -99.24 -171.67 2.12 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.398 0.679 . . . . 71.44 109.763 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' MET . . . . . 0.478 ' HE3' ' HB3' ' A' ' 82' ' ' ASP . 13.9 ttt -106.93 143.37 35.13 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.364 -0.976 . . . . 73.04 108.364 177.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -75.02 -56.61 4.56 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.561 0.744 . . . . 73.54 111.371 -174.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.445 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.7 tp-100 . . . . . 0 N--CA 1.485 1.316 0 C-N-CA 124.378 1.071 . . . . 74.52 109.127 -173.603 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.7 t . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 109.329 -0.619 . . . . 75.54 109.329 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -77.02 127.87 33.47 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 109.585 -0.524 . . . . 74.34 109.585 174.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.0 p -65.25 119.59 11.18 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.042 0.937 . . . . 73.22 111.502 -179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.0 mp -79.97 109.7 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.132 0.973 . . . . 70.43 109.028 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 96.4 t -91.94 114.81 29.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 108.664 -0.865 . . . . 65.35 108.664 178.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 70.4 mt -110.19 111.2 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 108.373 -0.973 . . . . 74.41 108.373 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -89.15 172.53 9.02 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 120.975 0.417 . . . . 75.23 110.25 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -65.24 -23.35 67.04 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.649 0.78 . . . . 75.43 110.935 170.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.2 p -79.45 -25.18 42.02 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.913 0.885 . . . . 73.24 111.145 175.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.407 ' O ' HG13 ' A' ' 58' ' ' ILE . 15.9 m-20 -83.86 55.91 3.46 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.643 0.777 . . . . 54.52 110.264 176.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -56.28 -35.79 67.88 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.81 0.844 . . . . 75.13 111.37 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.85 -42.67 84.92 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.123 0.969 . . . . 71.44 110.924 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.9 mt -79.13 -29.38 43.14 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.717 -0.674 . . . . 74.25 111.022 -178.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 54' ' ' ASP . 76.2 mt -63.36 -50.98 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 123.228 0.611 . . . . 75.25 109.557 175.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -59.9 -32.14 70.46 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.294 0.638 . . . . 71.25 110.572 176.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -78.34 -15.45 58.7 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 122.725 0.41 . . . . 73.53 111.68 -177.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 56.8 p -124.39 113.86 18.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.71 0.404 . . . . 74.15 110.881 -178.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -53.51 -47.43 69.9 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.138 1.375 . . . . 74.11 112.105 -176.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.459 ' HB2' ' OE1' ' A' ' 108' ' ' GLN . 24.9 tp -62.01 -39.99 94.15 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.143 -0.935 . . . . 73.12 111.97 -176.22 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.36 -45.58 93.0 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.245 0.618 . . . . 55.34 111.406 -177.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -54.69 -46.14 74.06 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.515 1.134 . . . . 75.1 110.863 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.417 ' HB3' HD23 ' A' ' 104' ' ' LEU . 18.3 mm100 -63.52 -45.54 90.15 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.108 0.963 . . . . 74.33 112.137 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.8 mt -65.11 -47.51 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.119 0.568 . . . . 75.41 111.171 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -65.65 -31.84 73.09 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.305 0.642 . . . . 64.41 111.501 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.34 -57.3 7.77 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.287 0.635 . . . . 74.14 111.063 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -72.2 -29.16 63.71 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.836 -0.62 . . . . 74.13 111.546 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.561 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 63.6 m -137.73 88.58 16.09 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 108.938 -0.764 . . . . 71.21 108.938 -179.161 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.79 -3.89 12.95 Favored 'Trans proline' 0 C--N 1.379 2.156 0 C-N-CA 123.052 2.501 . . . . 75.44 113.676 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.71 -15.72 80.96 Favored Glycine 0 C--N 1.352 1.418 0 O-C-N 123.196 0.31 . . . . 73.12 112.851 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.499 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 95.7 t -67.23 122.27 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 123.372 0.669 . . . . 72.35 109.649 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -83.31 -44.93 14.36 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.807 0.843 . . . . 74.11 110.739 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 61.5 p -155.01 170.92 20.65 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.511 0.672 . . . . 63.3 111.22 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 78.8 mt -129.97 156.72 43.98 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.93 1.292 . . . . 74.14 108.661 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.547 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 50.8 ttm -130.09 100.54 5.46 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.303 -1.369 . . . . 70.33 107.303 170.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.426 HD13 HG23 ' A' ' 115' ' ' VAL . 40.7 mm -74.67 107.73 5.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 107.547 -1.279 . . . . 74.33 107.547 176.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.66 -117.09 0.28 Allowed Glycine 0 C--N 1.34 0.777 0 N-CA-C 110.063 -1.215 . . . . 64.03 110.063 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.445 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 1.6 p-10 -149.32 -57.68 0.2 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.093 0.557 . . . . 75.04 109.657 171.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 0.478 ' HB3' ' HE3' ' A' ' 39' ' ' MET . 7.8 p-10 -83.69 -29.58 27.46 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.864 0.466 . . . . 65.43 109.791 170.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -116.47 170.3 8.67 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.982 0.913 . . . . 73.31 110.814 -174.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 46.0 tp -135.12 146.05 48.45 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.313 1.445 . . . . 72.23 107.471 171.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.547 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 35.5 m -127.71 130.18 48.4 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 109.132 -0.692 . . . . 73.34 109.132 175.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.1 mm -108.16 128.51 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 108.894 -0.78 . . . . 75.51 108.894 -178.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -109.11 107.2 17.42 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 108.882 -0.784 . . . . 73.12 108.882 178.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -106.6 163.59 12.76 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.216 0.606 . . . . 75.12 109.716 -178.821 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.65 145.23 38.95 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 122.635 0.374 . . . . 72.44 110.282 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -58.89 -34.94 72.22 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.181 0.992 . . . . 74.15 112.869 -173.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.8 mmm -70.85 -26.02 63.08 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.124 0.57 . . . . 73.23 110.559 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.5 t -91.77 142.3 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.044 -1.095 . . . . 75.14 108.044 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -109.03 146.2 34.32 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.944 0.498 . . . . 73.13 111.116 -174.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . 0.477 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 80.4 m95 -63.14 -13.54 38.0 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.054 0.941 . . . . 63.23 112.809 178.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -52.56 -39.71 61.78 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.173 0.989 . . . . 74.22 112.079 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 40.5 m -103.42 -0.53 29.88 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.366 0.667 . . . . 54.43 112.211 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.561 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 57.2 mt -109.49 -50.83 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 123.322 0.649 . . . . 72.32 111.275 -171.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.0 ttpm? -55.94 -51.74 78.08 Favored Pre-proline 0 CA--C 1.561 1.398 0 CA-C-O 117.778 -1.106 . . . . 74.51 113.28 -170.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.02 -33.65 91.74 Favored 'Trans proline' 0 C--N 1.4 3.266 0 C-N-CA 121.799 1.666 . . . . 71.41 112.157 -177.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.407 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 8.0 mm-40 -65.36 -47.51 76.17 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 115.513 -0.767 . . . . 75.41 110.24 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.1 mt -70.64 -37.97 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.042 0.537 . . . . 75.14 111.497 -177.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 97.9 mt -54.79 -44.37 71.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 N-CA-C 109.732 -0.47 . . . . 74.43 109.732 173.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . 0.451 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 32.5 t70 -67.19 -40.74 86.55 Favored 'General case' 0 C--N 1.351 0.671 0 CA-C-N 115.039 -0.982 . . . . 72.42 111.181 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.417 HD23 ' HB3' ' A' ' 66' ' ' GLN . 95.9 mt -61.86 -39.96 93.68 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.803 0.841 . . . . 74.31 111.96 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.425 HD13 HD12 ' A' ' 63' ' ' LEU . 10.9 mp -71.06 -21.26 62.27 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.597 -0.729 . . . . 74.53 110.628 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.406 HG23 ' HB ' ' A' ' 17' ' ' ILE . 24.0 m -81.73 -37.88 26.6 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.985 -0.746 . . . . 74.11 108.985 174.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 103' ' ' ASP . 11.0 mmpt? -59.33 -62.57 1.78 Allowed 'General case' 0 C--N 1.368 1.388 0 C-N-CA 124.041 0.936 . . . . 73.4 110.924 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.459 ' OE1' ' HB2' ' A' ' 63' ' ' LEU . 25.9 tt0 -55.41 -47.13 76.39 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 124.658 1.224 . . . . 74.44 111.652 -171.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.511 HD23 ' HB2' ' A' ' 38' ' ' GLU . 82.7 mt -70.83 -30.62 67.09 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 115.459 -0.791 . . . . 74.24 111.128 -178.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.39 -26.91 61.19 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.016 0.526 . . . . 73.05 111.348 176.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -72.77 -27.05 61.78 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.762 0.425 . . . . 71.33 110.148 170.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 91.59 36.02 6.67 Favored Glycine 0 C--N 1.346 1.117 0 N-CA-C 111.543 -0.623 . . . . 72.32 111.543 -177.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -120.54 159.57 24.94 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.155 0.982 . . . . 72.42 111.203 -173.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.9 174.02 6.06 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.338 1.055 . . . . 73.13 109.093 172.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.426 HG23 HD13 ' A' ' 79' ' ' ILE . 1.9 p . . . . . 0 CA--C 1.55 0.974 0 N-CA-C 112.909 0.707 . . . . 72.22 112.909 -171.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.43 HG22 HD13 ' A' ' 109' ' ' LEU . 59.2 mt . . . . . 0 C--O 1.237 0.407 0 N-CA-C 110.313 -0.255 . . . . 74.43 110.313 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -62.86 99.73 0.17 Allowed 'General case' 0 CA--C 1.548 0.884 0 O-C-N 124.032 0.833 . . . . 75.02 111.042 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.0 mm -119.66 107.0 20.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 106.044 -1.836 . . . . 73.21 106.044 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -99.36 127.57 45.4 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.392 -0.595 . . . . 74.43 109.392 -172.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.5 t -91.08 126.55 36.2 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-O 121.527 0.68 . . . . 71.43 109.635 -176.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.459 HD12 HD22 ' A' ' 33' ' ' LEU . 84.3 mt -123.58 138.08 54.62 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 124.566 1.146 . . . . 73.12 108.834 -176.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 62.3 p -74.73 147.95 40.9 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.539 -0.755 . . . . 74.14 110.621 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.7 p -117.31 162.97 25.49 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 123.977 0.911 . . . . 75.23 109.922 -176.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.83 -13.19 37.99 Favored 'Trans proline' 0 C--N 1.383 2.347 0 C-N-CA 122.6 2.2 . . . . 70.2 113.094 172.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -98.88 131.51 44.91 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.438 0.695 . . . . 74.43 109.208 175.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.8 -30.94 70.48 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.142 0.577 . . . . 65.32 111.164 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 26.8 p-10 -95.23 2.32 54.87 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.521 0.728 . . . . 74.14 112.401 -174.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -111.27 156.58 21.27 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.035 0.534 . . . . 64.43 110.188 174.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.7 tp -149.38 120.19 7.59 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 108.813 -0.81 . . . . 72.34 108.813 175.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -82.43 117.94 22.84 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.849 0.86 . . . . 75.0 110.194 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -100.26 119.34 38.24 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 107.73 -1.211 . . . . 74.01 107.73 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.459 HD22 HD12 ' A' ' 22' ' ' LEU . 27.3 tp -102.2 125.59 48.94 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.706 -0.85 . . . . 73.42 108.706 -172.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.5 m -85.61 105.87 16.5 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.206 -1.405 . . . . 70.5 107.206 175.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.9 p -94.05 101.11 13.13 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.533 0.733 . . . . 74.24 109.314 -178.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.4 t70 62.26 74.87 0.42 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.758 1.223 . . . . 72.34 111.033 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -151.85 -127.94 1.37 Allowed Glycine 0 C--N 1.342 0.865 0 CA-C-N 115.033 -0.985 . . . . 75.11 111.64 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.53 ' HB2' HD22 ' A' ' 109' ' ' LEU . 56.6 mm-40 -98.06 151.73 20.04 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 117.718 0.759 . . . . 73.14 111.269 178.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 12.0 tpt -88.04 99.75 12.41 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.146 -0.934 . . . . 75.51 108.902 177.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.04 -51.18 63.03 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.685 0.794 . . . . 70.01 111.986 -170.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.469 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.7 tp-100 . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 108.819 -0.808 . . . . 74.22 108.819 173.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.6 t . . . . . 0 CA--C 1.541 0.632 0 N-CA-C 107.984 -1.117 . . . . 62.32 107.984 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -61.2 146.22 48.46 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.398 0.679 . . . . 74.23 111.559 -178.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.5 p -69.68 97.74 1.1 Allowed 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 109.102 -0.703 . . . . 74.12 109.102 173.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 72.8 mt -72.44 109.49 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 115.709 -0.678 . . . . 72.11 110.366 -170.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.5 t -85.4 106.59 15.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 107.906 -1.146 . . . . 75.14 107.906 176.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.466 HG12 ' HB3' ' A' ' 57' ' ' LEU . 59.1 mt -96.33 109.65 23.24 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.349 0 N-CA-C 107.498 -1.297 . . . . 75.12 107.498 -177.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -92.4 160.18 15.22 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 117.737 0.244 . . . . 73.43 110.385 -178.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -66.76 -21.59 66.05 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.817 0.447 . . . . 64.31 111.382 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 10.0 t -93.06 -23.78 18.53 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.861 0.864 . . . . 75.35 110.536 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.14 69.82 10.52 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.235 -0.654 . . . . 65.12 109.235 174.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -64.2 -24.61 67.74 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.982 -1.008 . . . . 75.14 110.831 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -59.74 -36.83 77.4 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.95 0.9 . . . . 71.11 110.835 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.466 ' HB3' HG12 ' A' ' 50' ' ' ILE . 88.1 mt -82.9 -28.68 29.81 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.567 0.747 . . . . 70.12 111.517 176.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.447 HG21 ' HG2' ' A' ' 65' ' ' GLN . 61.7 mt -65.09 -40.14 87.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.45 0.7 . . . . 73.23 110.114 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -65.97 -17.11 64.46 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.113 0.565 . . . . 63.51 112.096 175.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -85.79 6.57 27.42 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.169 0.588 . . . . 61.43 112.31 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.2 t -159.74 114.83 2.38 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.247 0.619 . . . . 75.43 110.512 179.167 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.417 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 3.9 tppp? -63.16 -32.7 74.16 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.703 0.401 . . . . 75.44 110.844 173.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.446 HD12 ' HB3' ' A' ' 104' ' ' LEU . 44.8 tp -63.73 -41.18 98.09 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 122.783 0.433 . . . . 71.44 110.367 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.61 -44.57 96.16 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 123.16 0.584 . . . . 73.21 110.324 177.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.447 ' HG2' HG21 ' A' ' 58' ' ' ILE . 76.2 mt-30 -55.5 -42.93 75.12 Favored 'General case' 0 C--N 1.351 0.66 0 O-C-N 124.497 1.123 . . . . 72.44 110.973 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.417 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 14.6 mm100 -69.73 -38.29 76.81 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.124 0.569 . . . . 73.25 112.427 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . 0.424 HG23 HG22 ' A' ' 74' ' ' VAL . 81.8 mt -68.32 -48.16 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 122.716 0.406 . . . . 70.24 110.473 -178.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -65.19 -32.3 73.91 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.754 -0.657 . . . . 70.25 111.391 177.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.5 tp -67.66 -56.38 9.58 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.236 0.614 . . . . 71.51 110.692 177.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -59.41 -34.04 71.96 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.738 0.815 . . . . 73.45 112.015 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.502 ' SG ' HG23 ' A' ' 97' ' ' ILE . 63.8 m -137.05 114.89 10.02 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 110.183 -0.303 . . . . 73.55 110.183 -176.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -71.72 -11.04 27.45 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.327 2.018 . . . . 73.4 111.849 171.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -88.04 18.65 39.01 Favored Glycine 0 C--N 1.355 1.601 0 CA-C-O 119.79 -0.45 . . . . 74.32 113.277 -177.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.679 HG21 ' HZ1' ' A' ' 88' ' ' LYS . 15.1 t -97.54 124.79 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 108.794 -0.817 . . . . 75.43 108.794 172.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -84.2 -52.21 6.43 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.656 0.382 . . . . 73.25 110.297 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 97.1 p -156.18 172.31 18.67 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 112.057 0.391 . . . . 70.14 112.057 -177.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 34.5 mt -131.47 126.03 33.98 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 108.226 -1.027 . . . . 74.3 108.226 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.479 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.3 ttm -100.92 111.56 23.8 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.775 -0.824 . . . . 73.43 108.775 178.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.613 HD12 HD13 ' A' ' 84' ' ' LEU . 20.9 mm -86.16 98.05 6.48 Favored 'Isoleucine or valine' 0 C--N 1.349 0.564 0 N-CA-C 108.82 -0.807 . . . . 75.33 108.82 -177.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.06 176.27 42.15 Favored Glycine 0 C--O 1.243 0.715 0 N-CA-C 111.174 -0.77 . . . . 60.0 111.174 176.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.469 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 31.1 m-20 -51.48 -59.74 3.92 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.265 1.026 . . . . 74.1 111.611 -176.216 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -128.5 22.46 5.97 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.153 -1.385 . . . . 74.44 110.016 -174.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . 0.414 ' HB3' HD13 ' A' ' 33' ' ' LEU . 37.0 p90 -149.12 154.94 39.95 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 122.895 0.478 . . . . 74.54 110.789 -175.162 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.613 HD13 HD12 ' A' ' 79' ' ' ILE . 27.5 tp -131.34 110.95 11.44 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 108.082 -1.081 . . . . 73.22 108.082 176.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.479 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 41.7 m -100.01 109.73 22.05 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 108.48 -0.934 . . . . 70.24 108.48 -176.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.532 HG13 HD13 ' A' ' 101' ' ' ILE . 20.9 mm -86.38 131.71 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 N-CA-C 108.012 -1.107 . . . . 72.02 108.012 -175.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -112.0 124.44 52.4 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.017 -1.105 . . . . 74.14 108.017 178.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.679 ' HZ1' HG21 ' A' ' 74' ' ' VAL . 69.1 mttm -129.12 177.39 7.18 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.318 1.047 . . . . 73.55 109.475 -178.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.11 139.37 58.76 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.49 0.494 . . . . 72.3 109.956 168.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -62.1 -27.52 68.98 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.661 0.784 . . . . 74.3 112.571 -174.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 26.4 mmt -87.38 -16.72 34.14 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.584 0.354 . . . . 74.01 111.659 -178.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 72.6 t -75.57 133.76 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.395 -0.965 . . . . 73.5 108.395 173.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 65.5 m170 -104.53 148.88 25.99 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.25 0.548 . . . . 74.43 110.33 -176.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -76.94 -19.13 57.74 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.134 0.974 . . . . 75.55 112.262 -173.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -57.7 -26.95 62.45 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.901 0.48 . . . . 74.55 111.667 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -82.81 -52.49 6.69 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 122.961 0.505 . . . . 75.44 111.989 177.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.502 HG23 ' SG ' ' A' ' 71' ' ' CYS . 26.8 mt -93.94 -33.46 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 113.133 0.79 . . . . 74.12 113.133 -164.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -49.43 -46.74 78.16 Favored Pre-proline 0 CA--C 1.568 1.667 0 CA-C-O 117.564 -1.207 . . . . 75.5 113.784 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -56.0 -35.59 94.76 Favored 'Trans proline' 0 C--N 1.396 3.029 0 CA-C-N 121.626 1.616 . . . . 73.14 112.844 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -73.16 -34.83 66.27 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.207 0.603 . . . . 71.44 110.595 -179.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.532 HD13 HG13 ' A' ' 86' ' ' ILE . 84.0 mt -68.5 -49.06 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.481 0.712 . . . . 75.32 109.921 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 87.1 mt -58.23 -38.07 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.594 0.758 . . . . 74.2 110.301 177.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -61.98 -51.53 67.69 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.829 0.852 . . . . 73.42 110.923 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.446 ' HB3' HD12 ' A' ' 63' ' ' LEU . 69.7 mt -62.9 -39.38 94.33 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.09 0.956 . . . . 73.4 111.92 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.474 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 8.5 mp -70.42 -28.55 65.14 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.398 0.679 . . . . 63.13 110.5 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 94.8 m -69.58 -37.06 76.82 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 109.111 -0.699 . . . . 74.11 109.111 174.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -67.9 -44.95 75.76 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.053 0.541 . . . . 72.23 110.328 178.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -58.23 -47.23 84.18 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.447 1.099 . . . . 75.55 111.017 -178.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.53 HD22 ' HB2' ' A' ' 38' ' ' GLU . 18.0 mt -76.4 -26.55 55.7 Favored 'General case' 0 CA--C 1.553 1.08 0 CA-C-N 115.821 -0.627 . . . . 73.3 110.708 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.26 -21.88 60.52 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.042 0.537 . . . . 74.11 111.69 178.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -69.4 -24.81 63.9 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 110.133 -0.321 . . . . 71.52 110.133 170.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 71.76 38.52 60.82 Favored Glycine 0 C--N 1.347 1.161 0 N-CA-C 111.079 -0.808 . . . . 73.44 111.079 -174.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -135.59 160.4 38.62 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 124.11 0.964 . . . . 71.31 111.643 -173.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -78.93 152.59 31.01 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 114.404 -1.271 . . . . 74.11 109.293 177.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.484 1.253 0 C-N-CA 122.839 0.456 . . . . 73.54 110.535 178.489 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.434 ' H ' HG22 ' A' ' 106' ' ' THR . 64.5 mt . . . . . 0 N--CA 1.469 0.498 0 N-CA-C 109.304 -0.628 . . . . 74.45 109.304 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -71.89 136.18 46.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.521 -0.763 . . . . 74.51 109.229 -176.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 48.9 mm -118.55 143.32 29.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 N-CA-C 107.9 -1.148 . . . . 64.33 107.9 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.454 ' HD2' HD22 ' A' ' 33' ' ' LEU . 40.4 ttmt -91.49 114.97 27.64 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.421 -0.585 . . . . 64.22 109.421 -177.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 97.6 m -95.05 120.88 36.01 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 108.93 -0.767 . . . . 74.54 108.93 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.6 mt -125.23 141.91 51.81 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.333 1.053 . . . . 72.43 109.536 -174.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.6 p -73.97 143.37 45.67 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.143 0.577 . . . . 72.24 110.44 174.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.3 p -111.95 160.89 28.19 Favored Pre-proline 0 N--CA 1.478 0.947 0 C-N-CA 124.245 1.018 . . . . 74.13 109.401 -178.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -79.29 30.85 0.47 Allowed 'Trans proline' 0 C--N 1.375 1.95 0 C-N-CA 123.192 2.595 . . . . 73.34 112.855 172.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -142.28 127.43 18.57 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.398 -0.964 . . . . 74.23 108.398 -177.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -73.2 158.22 35.66 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.382 -0.599 . . . . 63.12 109.382 173.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 70.49 -6.46 1.19 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.113 1.365 . . . . 74.35 111.68 -173.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -117.57 145.51 44.23 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 124.101 0.961 . . . . 75.11 109.758 -172.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.6 tp -153.2 129.69 10.67 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 108.864 -0.791 . . . . 75.54 108.864 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -82.82 131.53 35.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.754 0.821 . . . . 74.25 111.127 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -122.19 114.37 20.76 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.977 -1.49 . . . . 73.21 106.977 172.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.454 HD22 ' HD2' ' A' ' 20' ' ' LYS . 52.7 tp -113.86 127.92 56.19 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 123.983 0.913 . . . . 74.41 110.269 -165.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 m -90.29 103.73 16.38 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.156 -1.053 . . . . 73.54 108.156 177.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 73.5 p -102.34 -11.45 18.66 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.966 0.907 . . . . 72.44 111.578 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -62.88 -44.93 94.79 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.943 0.897 . . . . 73.43 111.875 -177.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 150.83 -32.4 0.98 Allowed Glycine 0 C--N 1.346 1.108 0 CA-C-N 116.277 -0.42 . . . . 53.32 113.184 178.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -69.98 106.66 3.28 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.036 0.446 . . . . 74.33 109.829 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.5 tpt -85.2 133.97 34.17 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.319 1.048 . . . . 75.53 109.865 -171.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.415 ' O ' HG11 ' A' ' 115' ' ' VAL . 73.5 mt -70.46 -35.59 73.41 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.473 0.709 . . . . 73.41 112.756 -172.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 . . . . . 0 N--CA 1.48 1.063 0 N-CA-C 107.874 -1.158 . . . . 75.11 107.874 172.317 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.55 ' HB3' ' HB3' ' A' ' 81' ' ' ASP . 35.1 t . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 121.117 0.484 . . . . 73.11 110.908 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -81.22 154.28 26.73 Favored 'General case' 0 C--O 1.246 0.892 0 C-N-CA 123.932 0.893 . . . . 73.11 110.116 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.0 p -79.39 91.47 5.09 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.902 0.481 . . . . 72.23 109.825 176.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.3 mt -75.77 116.69 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.018 0.927 . . . . 75.31 109.866 -176.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.5 t -90.88 119.28 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 108.579 -0.897 . . . . 72.34 108.579 178.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.404 HG21 ' HB2' ' A' ' 57' ' ' LEU . 61.3 mt -117.11 110.65 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 107.775 -1.194 . . . . 72.13 107.775 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.528 ' HZ2' ' HB2' ' A' ' 51' ' ' LYS . 10.2 mtmp? -93.29 172.58 8.2 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 109.595 -0.52 . . . . 74.15 109.595 177.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.9 p30 -64.7 -21.15 66.68 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.212 0.605 . . . . 70.15 112.345 -177.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.5 t -83.92 -21.18 31.95 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 122.507 0.323 . . . . 74.23 110.717 176.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -83.23 56.33 3.49 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.999 0.92 . . . . 73.42 110.296 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . 0.414 ' HA ' HD13 ' A' ' 58' ' ' ILE . 34.5 tt0 -63.73 -25.72 68.32 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.457 0.703 . . . . 63.22 111.667 -175.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.18 -45.51 93.08 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.79 0.836 . . . . 74.55 110.281 173.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.45 ' HA ' ' HD2' ' A' ' 60' ' ' HIS . 87.0 mt -73.29 -30.03 63.13 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 115.703 -0.681 . . . . 75.14 111.106 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.414 HD13 ' HA ' ' A' ' 55' ' ' GLU . 75.5 mt -65.28 -39.06 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.203 0.601 . . . . 73.03 109.427 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -70.68 -10.85 60.34 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 112.965 0.728 . . . . 73.21 112.965 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.45 ' HD2' ' HA ' ' A' ' 57' ' ' LEU . 83.2 m-70 -80.79 -34.3 34.19 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.701 0.4 . . . . 61.53 110.619 170.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.3 t -108.65 106.78 16.98 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.326 0.65 . . . . 61.43 110.611 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -54.77 -37.51 66.09 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.392 0.677 . . . . 72.15 110.809 173.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.13 -42.55 99.52 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.537 0.735 . . . . 74.11 111.033 178.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.79 -45.08 93.41 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 122.819 0.448 . . . . 72.41 109.833 178.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -55.95 -44.38 78.37 Favored 'General case' 0 C--N 1.353 0.734 0 O-C-N 124.065 0.853 . . . . 74.13 110.812 177.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -62.36 -46.56 88.09 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.69 0.796 . . . . 75.1 112.069 178.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.9 mt -64.71 -49.83 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 C-N-CA 123.641 0.776 . . . . 61.44 111.065 -175.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -66.76 -36.19 81.85 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.417 0.687 . . . . 72.2 111.502 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.9 tp -64.99 -46.6 80.76 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.444 0.698 . . . . 74.33 110.835 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . 0.471 ' NE2' HD22 ' A' ' 104' ' ' LEU . 75.3 mt-30 -73.21 -28.92 62.45 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.123 -0.944 . . . . 63.3 111.642 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.468 ' SG ' HD12 ' A' ' 97' ' ' ILE . 42.9 t -149.08 104.16 3.36 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 122.47 0.308 . . . . 73.34 110.783 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -78.08 14.55 1.51 Allowed 'Trans proline' 0 C--N 1.373 1.816 0 C-N-CA 122.738 2.292 . . . . 64.05 112.745 171.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -85.77 -18.42 59.9 Favored Glycine 0 C--N 1.35 1.322 0 N-CA-C 111.764 -0.535 . . . . 75.03 111.764 170.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.413 ' HA ' ' HB3' ' A' ' 88' ' ' LYS . 87.7 t -70.74 114.59 8.89 Favored 'Isoleucine or valine' 0 C--N 1.351 0.669 0 N-CA-C 109.228 -0.656 . . . . 70.24 109.228 175.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -86.02 -32.95 21.19 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.264 0.626 . . . . 72.51 110.678 -174.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.412 ' HB2' ' HG2' ' A' ' 51' ' ' LYS . 33.4 t -161.45 167.14 26.13 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 121.345 0.593 . . . . 73.33 111.319 -175.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 76.7 mt -134.4 128.61 33.92 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.721 1.208 . . . . 74.42 107.928 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.468 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 54.1 ttm -96.21 108.18 20.61 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 107.371 -1.344 . . . . 74.41 107.371 168.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 20.1 mm -91.33 105.38 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.437 0.695 . . . . 74.04 109.146 -174.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.87 163.29 24.5 Favored Glycine 0 C--O 1.242 0.636 0 N-CA-C 109.657 -1.377 . . . . 61.52 109.657 173.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . 0.55 ' HB3' ' HB3' ' A' ' 45' ' ' SER . 19.3 p-10 -74.08 -34.92 64.18 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 122.885 0.474 . . . . 71.32 110.595 175.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -99.55 -32.86 10.89 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.933 0.893 . . . . 73.04 111.259 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -131.28 169.28 16.19 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.276 0.63 . . . . 74.2 111.739 -170.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 54.2 tp -141.12 109.94 6.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.625 0.77 . . . . 73.42 109.619 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.468 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 59.8 m -100.79 111.57 23.82 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.713 -0.847 . . . . 74.51 108.713 -178.403 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.514 HG13 HD12 ' A' ' 101' ' ' ILE . 27.2 mm -86.99 126.22 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.487 -0.931 . . . . 71.42 108.487 -176.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -108.52 124.63 50.75 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.355 -0.98 . . . . 71.53 108.355 176.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.417 ' HD2' HD13 ' A' ' 97' ' ' ILE . 0.6 OUTLIER -150.2 152.96 35.45 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.228 1.011 . . . . 75.04 109.154 -177.042 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -60.57 132.32 53.54 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.203 0.601 . . . . 65.22 110.427 -172.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -62.39 -23.4 66.81 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.633 1.173 . . . . 75.12 112.493 -175.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.2 mmt -66.21 -30.86 71.39 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.865 0.466 . . . . 75.45 110.679 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.6 t -92.98 142.83 12.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 N-CA-C 107.151 -1.426 . . . . 73.51 107.151 172.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -102.72 156.82 17.38 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.34 0.59 . . . . 64.31 111.579 -176.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -69.02 -17.84 63.96 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 114.629 -1.169 . . . . 64.13 111.795 179.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -56.01 -31.08 62.75 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.756 0.822 . . . . 74.43 111.806 -177.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.9 m -92.08 -36.17 13.5 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.382 0.673 . . . . 64.31 112.034 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.468 HD12 ' SG ' ' A' ' 71' ' ' CYS . 30.4 mt -97.74 -43.15 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 N-CA-C 112.305 0.483 . . . . 72.42 112.305 -164.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -51.78 -46.15 91.86 Favored Pre-proline 0 N--CA 1.492 1.634 0 CA-C-O 117.76 -1.114 . . . . 73.4 113.68 -177.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -53.83 -41.88 70.98 Favored 'Trans proline' 0 C--N 1.402 3.361 0 C-N-CA 121.839 1.693 . . . . 73.14 112.337 173.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -67.66 -39.48 84.56 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.345 -0.843 . . . . 70.35 110.486 -178.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.514 HD12 HG13 ' A' ' 86' ' ' ILE . 93.7 mt -62.89 -51.54 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.572 0.749 . . . . 72.45 110.395 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 83.7 mt -59.8 -38.28 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 O-C-N 123.748 0.655 . . . . 73.11 110.682 -178.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -67.94 -39.31 83.46 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.018 0.927 . . . . 71.24 111.278 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.471 HD22 ' NE2' ' A' ' 70' ' ' GLN . 77.7 mt -65.72 -39.99 91.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.565 0.746 . . . . 73.11 111.799 174.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 10.8 mp -68.99 -25.0 64.3 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.032 0.533 . . . . 75.02 110.36 176.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.434 HG22 ' H ' ' A' ' 17' ' ' ILE . 88.6 m -71.61 -50.91 26.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 122.984 0.514 . . . . 73.31 110.038 176.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -65.67 -36.47 83.75 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 123.386 0.429 . . . . 73.52 110.879 -176.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -59.41 -56.33 23.37 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 122.72 0.408 . . . . 64.54 110.62 177.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 105' ' ' LEU . 50.2 mt -69.65 -22.47 63.45 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 123.792 0.683 . . . . 74.42 111.333 -176.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.67 -35.84 70.43 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.567 0.747 . . . . 75.12 111.888 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -108.26 -13.47 14.89 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 122.952 0.501 . . . . 74.11 111.474 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -148.7 -159.12 8.35 Favored Glycine 0 C--N 1.345 1.063 0 N-CA-C 112.082 -0.407 . . . . 75.01 112.082 -175.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -131.85 -60.17 0.93 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.754 0.822 . . . . 72.11 109.106 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -79.87 171.38 15.19 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.31 -1.314 . . . . 65.2 111.98 -174.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.415 HG11 ' O ' ' A' ' 40' ' ' LEU . 5.4 p . . . . . 0 CA--C 1.541 0.634 0 CA-C-N 114.085 -1.416 . . . . 74.31 109.874 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.426 ' HB ' ' HA ' ' A' ' 106' ' ' THR . 69.0 mt . . . . . 0 N--CA 1.467 0.415 0 CA-C-O 120.934 0.397 . . . . 73.52 110.78 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -83.1 131.13 35.16 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 124.568 1.147 . . . . 75.5 110.47 -175.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . 0.407 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.9 mm -130.17 121.32 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 N-CA-C 108.059 -1.089 . . . . 74.22 108.059 -175.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -90.77 143.34 26.83 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.732 1.213 . . . . 75.23 110.021 -179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 47.1 m -101.83 120.28 40.12 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 123.43 0.692 . . . . 75.21 109.727 175.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.8 mt -125.16 138.17 54.15 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.133 0.973 . . . . 74.13 109.633 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.5 p -86.66 144.46 27.13 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.06 0.544 . . . . 74.34 110.615 178.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.4 p -108.34 172.78 3.44 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 124.875 1.27 . . . . 75.24 108.469 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -75.57 50.56 2.72 Favored 'Trans proline' 0 C--N 1.376 2.001 0 C-N-CA 122.13 1.887 . . . . 74.45 112.372 168.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -162.27 141.14 9.21 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.344 1.058 . . . . 73.54 108.504 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.29 -31.94 13.86 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.137 0.575 . . . . 62.44 110.593 -177.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -89.78 7.49 36.65 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.916 0.886 . . . . 74.15 111.798 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.46 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -136.53 126.17 25.4 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.796 0.838 . . . . 63.22 109.052 174.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.1 tp -128.42 134.24 48.74 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.461 0.704 . . . . 74.41 109.177 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -90.87 129.74 36.89 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.479 1.111 . . . . 75.25 110.538 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -114.7 116.41 28.65 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.717 -1.216 . . . . 75.34 107.717 171.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.4 tp -100.06 127.32 46.31 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.451 -1.314 . . . . 75.02 107.451 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.2 t -72.39 107.33 4.91 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 107.254 -1.388 . . . . 73.25 107.254 171.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t -105.64 18.97 21.33 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.474 0.654 . . . . 75.02 109.73 -179.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -91.32 -55.5 3.49 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.368 0.667 . . . . 64.44 109.888 177.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 156.65 -17.13 0.41 Allowed Glycine 0 C--N 1.344 1.024 0 CA-C-N 115.908 -0.587 . . . . 62.23 113.171 -175.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -84.92 105.76 15.93 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.24 0.616 . . . . 73.3 111.229 -176.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 40.2 ttm -74.97 132.91 41.73 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.502 -0.555 . . . . 75.11 109.502 175.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.3 mt -62.64 -48.72 78.12 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.826 0.704 . . . . 73.22 111.342 -177.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 . . . . . 0 CA--C 1.54 0.575 0 CA-C-N 116.182 -0.463 . . . . 73.44 109.843 -179.662 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m . . . . . 0 N--CA 1.472 0.642 0 CA-C-O 121.018 0.437 . . . . 75.25 110.79 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -97.3 126.6 42.63 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.755 -1.202 . . . . 75.13 107.755 170.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.8 m -59.56 121.53 11.8 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.853 0.861 . . . . 75.51 112.995 -169.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 61.4 mt -87.34 130.89 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.011 0.925 . . . . 72.51 110.085 -178.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.5 t -97.46 108.64 21.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 N-CA-C 109.263 -0.643 . . . . 75.35 109.263 178.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 72.1 mt -90.38 110.04 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.549 1.14 . . . . 75.33 107.961 175.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -84.24 144.36 28.98 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.544 0.738 . . . . 72.43 110.205 -174.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.8 p-10 -65.79 -29.27 69.73 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.086 0.554 . . . . 72.15 111.321 175.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 t -82.15 -14.38 55.76 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.818 0.847 . . . . 75.13 111.208 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -102.61 82.46 2.15 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.232 -1.025 . . . . 74.14 108.232 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.5 -25.05 59.21 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.117 0.967 . . . . 75.04 112.519 -178.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -65.39 -52.68 51.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.201 0.601 . . . . 74.34 110.992 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.45 -36.18 77.61 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.951 0.5 . . . . 73.03 110.39 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.46 -47.12 90.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 115.023 -0.99 . . . . 72.22 110.522 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . 0.431 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 91.2 m-20 -62.12 -32.19 72.73 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.334 0.654 . . . . 75.34 112.42 -178.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -80.08 -6.47 57.73 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.018 0.527 . . . . 75.31 112.047 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.4 p -131.65 104.46 6.94 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.426 0.691 . . . . 74.11 109.558 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -52.21 -38.28 57.47 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.146 0.978 . . . . 75.2 112.285 -178.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.469 HD13 HD11 ' A' ' 105' ' ' LEU . 22.7 tp -61.89 -42.29 98.9 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 123.975 0.797 . . . . 73.2 111.769 179.098 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.47 -44.12 95.37 Favored 'General case' 0 C--N 1.351 0.669 0 O-C-N 123.66 0.6 . . . . 74.32 110.804 -177.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.431 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 98.6 mt-30 -54.86 -48.04 73.43 Favored 'General case' 0 C--N 1.348 0.525 0 O-C-N 124.122 0.889 . . . . 74.54 110.643 176.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -63.48 -44.62 93.87 Favored 'General case' 0 CA--C 1.552 1.028 0 O-C-N 123.87 0.731 . . . . 72.35 112.84 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -65.77 -49.68 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 123.328 0.651 . . . . 73.31 110.868 -176.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -69.93 -30.0 67.29 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.656 0.382 . . . . 74.44 111.809 -178.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 67.1 tp -64.11 -48.72 75.01 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.59 0.756 . . . . 72.41 110.693 175.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -86.78 -16.88 34.93 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.068 -0.969 . . . . 74.2 111.943 -173.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 54.0 t -149.44 104.62 3.29 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 122.928 0.491 . . . . 73.51 110.383 177.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -78.94 5.72 5.49 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.671 2.247 . . . . 71.42 112.765 172.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.23 -26.68 67.76 Favored Glycine 0 C--N 1.354 1.539 0 N-CA-C 112.262 -0.335 . . . . 44.21 112.262 176.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.408 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 40.7 t -75.36 127.73 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.056 0.542 . . . . 75.32 110.368 -176.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -89.06 -36.43 15.78 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.282 1.033 . . . . 74.43 111.026 -177.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.1 p -164.63 162.02 21.24 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 121.339 0.59 . . . . 62.51 111.633 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.9 mt -118.72 131.14 56.13 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.609 1.163 . . . . 70.54 108.168 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.508 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 43.0 ttm -105.21 103.85 13.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.407 -0.96 . . . . 54.35 108.407 175.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.477 HD12 HD11 ' A' ' 84' ' ' LEU . 49.3 mm -82.38 106.92 13.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 124.447 1.099 . . . . 75.13 108.773 -177.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.54 -163.9 39.55 Favored Glycine 0 C--O 1.246 0.863 0 O-C-N 123.688 0.617 . . . . 74.24 111.876 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -64.24 -66.16 0.58 Allowed 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.61 0.719 . . . . 65.34 110.036 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -127.89 10.57 6.51 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 114.055 -1.43 . . . . 73.11 109.603 -175.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -132.52 153.59 50.79 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.987 0.915 . . . . 73.55 110.344 -174.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.477 HD11 HD12 ' A' ' 79' ' ' ILE . 46.0 tp -131.64 117.96 19.39 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.221 1.008 . . . . 63.03 109.524 -175.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 28.9 m -105.16 111.43 24.19 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.288 -0.634 . . . . 75.0 109.288 -178.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.507 HG13 HD11 ' A' ' 101' ' ' ILE . 22.4 mm -88.01 126.99 41.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 123.31 0.644 . . . . 73.54 109.335 -175.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -104.2 109.61 21.5 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.227 -1.027 . . . . 70.32 108.227 174.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.84 166.24 10.62 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.617 0.767 . . . . 61.21 111.047 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -69.42 142.91 53.75 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 124.214 0.946 . . . . 63.14 110.117 175.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -54.9 -29.25 55.41 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 124.494 1.118 . . . . 72.01 113.429 -173.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 90.6 mmm -83.54 -31.72 26.25 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.128 0.571 . . . . 65.01 111.913 -178.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . 0.49 HG11 HD12 ' A' ' 97' ' ' ILE . 17.9 t -88.23 122.95 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 109.592 -0.521 . . . . 74.34 109.592 -170.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -95.18 152.02 18.71 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.243 0.617 . . . . 65.0 111.281 -166.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -62.3 -26.21 68.29 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.725 0.81 . . . . 75.11 112.683 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -51.74 -33.42 34.62 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.024 0.929 . . . . 74.4 112.487 -178.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 43.0 p -91.46 -45.49 8.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.302 0.641 . . . . 74.52 111.416 178.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.49 HD12 HG11 ' A' ' 92' ' ' VAL . 4.9 mt -79.89 -47.15 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 122.409 0.283 . . . . 74.41 110.959 -163.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -50.77 -53.17 49.87 Favored Pre-proline 0 N--CA 1.487 1.389 0 N-CA-C 114.845 1.424 . . . . 73.43 114.845 -170.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.32 -36.19 95.09 Favored 'Trans proline' 0 C--N 1.385 2.461 0 C-N-CA 121.784 1.656 . . . . 74.34 112.396 -177.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 45.2 mt-10 -76.83 -30.84 56.52 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 114.819 -1.082 . . . . 75.43 111.503 -177.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.507 HD11 HG13 ' A' ' 86' ' ' ILE . 69.1 mt -66.32 -52.7 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 N-CA-C 109.604 -0.517 . . . . 74.44 109.604 173.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . 0.407 HG23 ' HB ' ' A' ' 19' ' ' ILE . 73.6 mt -57.66 -37.41 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 123.967 0.792 . . . . 72.13 110.745 -178.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -58.97 -44.22 91.49 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.931 0.893 . . . . 65.53 111.165 175.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 81.8 mt -67.72 -33.35 74.71 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.673 0.789 . . . . 73.34 111.548 177.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.469 HD11 HD13 ' A' ' 63' ' ' LEU . 11.1 mp -70.09 -22.7 63.01 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.14 0.576 . . . . 75.24 110.696 174.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.426 ' HA ' ' HB ' ' A' ' 17' ' ' ILE . 25.3 m -82.45 -35.83 27.15 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 109.459 -0.571 . . . . 73.13 109.459 177.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -71.87 -64.23 0.98 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.187 0.595 . . . . 75.01 111.798 178.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.444 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 2.8 tt0 -58.79 -48.65 80.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.149 0.579 . . . . 75.12 112.1 -167.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.87 -25.46 66.69 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 124.072 0.858 . . . . 72.02 111.919 -176.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.05 -30.1 63.47 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.52 0.728 . . . . 75.53 111.332 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -87.45 -27.44 22.7 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.265 0.626 . . . . 73.25 110.463 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 177.28 123.86 0.81 Allowed Glycine 0 C--N 1.341 0.841 0 N-CA-C 111.492 -0.643 . . . . 54.5 111.492 -176.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -26.34 67.86 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.186 0.994 . . . . 73.34 112.118 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -60.59 102.16 0.17 Allowed 'General case' 0 CA--C 1.545 0.781 0 O-C-N 123.507 0.505 . . . . 71.32 110.913 173.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 8.1 p . . . . . 0 C--N 1.353 0.761 0 N-CA-C 109.365 -0.606 . . . . 74.21 109.365 169.873 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.2 mt . . . . . 0 C--O 1.24 0.594 0 N-CA-C 109.965 -0.383 . . . . 74.24 109.965 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -67.67 115.44 7.25 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.229 1.012 . . . . 75.21 109.91 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 40.8 mm -128.99 114.69 33.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 N-CA-C 105.272 -2.121 . . . . 75.35 105.272 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -100.06 137.14 38.92 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 109.273 -0.64 . . . . 71.44 109.273 -172.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.2 m -92.15 120.67 32.97 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.832 0.853 . . . . 74.22 109.852 -176.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 71.1 mt -128.62 137.95 51.94 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.135 0.974 . . . . 75.33 108.819 -179.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 44.5 p -87.55 147.25 25.42 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.018 0.527 . . . . 74.11 110.084 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.5 p -109.96 165.92 11.75 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 108.796 -0.816 . . . . 70.22 108.796 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -66.42 -16.68 52.04 Favored 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.008 1.805 . . . . 71.23 111.849 169.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -79.72 135.28 36.49 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.209 1.003 . . . . 71.25 109.347 178.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -80.94 147.91 30.06 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.949 0.5 . . . . 73.21 109.747 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 55.44 23.91 6.26 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.575 1.15 . . . . 73.2 112.631 -178.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -128.55 121.61 29.18 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 124.742 1.217 . . . . 71.45 107.959 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.6 tp -126.93 125.46 41.58 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.677 -0.49 . . . . 74.12 109.677 -173.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -82.82 107.24 15.29 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.248 1.019 . . . . 74.12 110.462 -177.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -93.46 116.12 28.66 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.203 -1.036 . . . . 75.12 108.203 173.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 43.7 tp -102.75 125.54 49.53 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.52 0.728 . . . . 75.32 109.181 -173.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 p -73.71 102.56 4.0 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 107.611 -1.255 . . . . 75.2 107.611 170.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.6 m -82.44 -33.01 28.7 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.981 0.913 . . . . 75.23 111.741 -164.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -60.49 -41.14 93.65 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.337 0.655 . . . . 72.43 111.537 177.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.76 7.43 1.39 Allowed Glycine 0 C--N 1.342 0.872 0 CA-C-O 119.097 -0.835 . . . . 62.54 114.032 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -64.31 151.0 44.99 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 117.67 0.735 . . . . 75.2 109.795 175.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 17.0 ttt -125.88 131.07 52.44 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.453 -0.573 . . . . 72.51 109.453 -178.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.4 mt -95.05 -46.84 6.64 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.432 0.693 . . . . 73.42 111.462 -171.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.437 ' NE2' HG13 ' A' ' 48' ' ' ILE . 6.3 tp-100 . . . . . 0 N--CA 1.483 1.203 0 C-N-CA 123.028 0.531 . . . . 72.04 110.305 175.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 26.0 t . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 120.747 0.308 . . . . 73.42 110.587 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -80.17 155.62 27.34 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.055 0.942 . . . . 75.52 112.103 -174.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.2 m -67.29 107.63 2.45 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.01 0.924 . . . . 73.12 110.147 175.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.437 HG13 ' NE2' ' A' ' 41' ' ' GLN . 39.4 mt -73.85 100.67 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 109.694 -0.484 . . . . 71.04 109.694 -175.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.2 t -84.51 106.67 14.9 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 N-CA-C 107.975 -1.12 . . . . 74.33 107.975 175.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.466 HG21 ' HB3' ' A' ' 57' ' ' LEU . 54.5 mt -95.49 106.87 18.8 Favored 'Isoleucine or valine' 0 C--N 1.34 0.153 0 N-CA-C 107.828 -1.175 . . . . 73.45 107.828 -175.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.424 ' HE3' ' HB2' ' A' ' 54' ' ' ASP . 47.1 mtmt -91.64 135.39 33.91 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.161 -0.681 . . . . 74.11 109.161 -177.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.429 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 36.1 p30 -63.12 -23.58 67.51 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.169 0.587 . . . . 72.2 111.814 177.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.4 t -80.97 -13.96 58.4 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.898 0.879 . . . . 75.32 111.469 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.424 ' HB2' ' HE3' ' A' ' 51' ' ' LYS . 12.8 t0 -111.38 79.27 1.19 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.116 -1.068 . . . . 71.03 108.116 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -55.58 -32.68 63.26 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 125.627 1.571 . . . . 75.3 113.609 -169.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -62.45 -31.58 72.32 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.076 0.951 . . . . 75.15 111.928 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.466 ' HB3' HG21 ' A' ' 50' ' ' ILE . 75.4 mt -67.77 -35.46 78.74 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.846 0.858 . . . . 75.14 111.518 174.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.98 -48.72 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 108.554 -0.906 . . . . 74.32 108.554 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -54.1 -31.14 51.13 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.803 1.241 . . . . 73.23 112.726 -176.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.5 m170 -86.99 -45.67 10.55 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.059 0.543 . . . . 51.33 110.996 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' SER . . . . . 0.454 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 22.2 m -87.35 106.1 17.71 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.081 0.553 . . . . 74.43 111.792 -172.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.0 ttmm -49.61 -52.2 32.14 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 125.542 1.537 . . . . 74.32 112.726 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.583 HD11 HD12 ' A' ' 105' ' ' LEU . 33.7 tp -61.79 -36.0 79.8 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.699 -1.137 . . . . 73.22 111.451 -177.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.437 ' HA ' HD12 ' A' ' 77' ' ' LEU . . . -65.32 -41.3 94.14 Favored 'General case' 0 C--N 1.352 0.703 0 C-N-CA 123.236 0.614 . . . . 75.44 111.161 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 61' ' ' SER . 78.5 mt-30 -56.21 -49.97 72.59 Favored 'General case' 0 C--N 1.352 0.684 0 O-C-N 124.143 0.902 . . . . 74.43 109.901 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.472 ' HB3' HD23 ' A' ' 104' ' ' LEU . 29.5 mm-40 -61.17 -50.75 71.87 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.305 1.042 . . . . 71.31 113.38 179.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 74.1 mt -66.17 -46.78 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 C-N-CA 122.839 0.456 . . . . 73.32 111.131 -174.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -70.42 -30.47 67.34 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.867 0.467 . . . . 73.04 112.054 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.9 tp -68.51 -58.79 3.78 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.75 0.42 . . . . 75.31 110.464 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.23 -19.54 56.49 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.563 -0.744 . . . . 71.23 112.015 -175.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.465 ' SG ' HG23 ' A' ' 97' ' ' ILE . 63.8 m -139.45 81.32 20.54 Favored Pre-proline 0 CA--C 1.554 1.127 0 N-CA-C 109.103 -0.703 . . . . 72.44 109.103 176.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.4 -6.93 16.18 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 122.988 2.459 . . . . 72.12 113.749 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -79.55 -7.37 88.54 Favored Glycine 0 C--N 1.353 1.475 0 CA-C-O 120.016 -0.325 . . . . 72.32 113.124 178.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 98.8 t -79.21 130.61 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 123.609 0.764 . . . . 72.4 109.225 172.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . 0.429 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 20.7 mm-40 -87.09 -46.76 9.49 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.145 0.978 . . . . 73.34 111.478 -176.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.7 p -157.88 156.53 31.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.697 -0.683 . . . . 75.04 110.838 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 64' ' ' ALA . 38.8 mt -108.18 167.21 10.17 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 107.931 -1.137 . . . . 73.42 107.931 171.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.59 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.9 ttm -142.8 103.89 4.26 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 106.871 -1.529 . . . . 73.35 106.871 169.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.484 HD12 HD11 ' A' ' 84' ' ' LEU . 28.9 mm -77.21 100.74 2.84 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 N-CA-C 107.73 -1.211 . . . . 73.34 107.73 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.15 173.02 32.63 Favored Glycine 0 C--O 1.241 0.568 0 N-CA-C 110.645 -0.982 . . . . 70.11 110.645 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -55.68 -66.61 0.39 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.901 0.881 . . . . 75.22 110.351 -173.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -105.05 -0.74 26.46 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 114.144 -1.389 . . . . 72.02 110.984 -176.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -137.7 168.16 20.24 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 122.947 0.499 . . . . 74.35 111.709 -166.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.484 HD11 HD12 ' A' ' 79' ' ' ILE . 48.9 tp -139.4 114.19 9.34 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.23 1.012 . . . . 74.23 108.71 176.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.59 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 31.0 m -96.13 106.63 18.84 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.481 -0.933 . . . . 74.44 108.481 -178.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.507 HG13 HD13 ' A' ' 101' ' ' ILE . 20.2 mm -87.87 117.96 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 108.103 -1.073 . . . . 74.45 108.103 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -104.58 125.7 50.96 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 107.522 -1.288 . . . . 74.42 107.522 174.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.46 169.89 16.57 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.553 0.741 . . . . 73.33 110.841 -174.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -81.37 142.51 32.96 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 115.535 -0.757 . . . . 73.13 109.263 178.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -80.25 0.96 30.41 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.893 0.877 . . . . 75.11 112.906 -173.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 23.1 ptp -78.34 -22.53 47.9 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 120.679 0.276 . . . . 73.25 110.552 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 18.9 t -102.54 147.35 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 123.743 0.817 . . . . 73.14 109.666 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -76.14 158.67 31.49 Favored 'General case' 0 CA--C 1.564 1.488 0 C-N-CA 124.1 0.96 . . . . 73.45 110.618 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 2.2 m95 -82.04 -56.03 4.2 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.703 0.801 . . . . 73.15 112.179 -179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -60.8 -18.8 57.54 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 124.563 1.145 . . . . 72.34 112.276 -177.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 71.9 p -77.04 -39.29 50.61 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.673 0.789 . . . . 74.13 110.647 177.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.465 HG23 ' SG ' ' A' ' 71' ' ' CYS . 28.8 mt -79.93 -29.55 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.281 0 C-N-CA 123.631 0.772 . . . . 74.33 110.655 178.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.461 ' HZ2' ' HB3' ' A' ' 98' ' ' LYS . 6.4 ttpm? -57.74 -45.2 99.84 Favored Pre-proline 0 CA--C 1.578 2.029 0 N-CA-C 114.608 1.336 . . . . 74.21 114.608 -169.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -62.72 -32.81 78.28 Favored 'Trans proline' 0 C--N 1.398 3.169 0 CA-C-N 122.185 1.816 . . . . 74.41 111.557 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -63.29 -51.25 66.86 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.888 0.875 . . . . 73.55 110.019 174.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.507 HD13 HG13 ' A' ' 86' ' ' ILE . 83.2 mt -58.65 -56.05 19.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.495 0.718 . . . . 74.22 110.684 -178.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 67.4 mt -55.61 -39.57 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 C-N-CA 123.727 0.811 . . . . 74.41 111.173 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.72 -50.95 69.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.336 0.654 . . . . 75.41 111.01 178.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.472 HD23 ' HB3' ' A' ' 66' ' ' GLN . 74.4 mt -67.13 -32.7 74.0 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.11 0.964 . . . . 73.32 111.883 -176.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.583 HD12 HD11 ' A' ' 63' ' ' LEU . 9.5 mp -69.88 -29.17 66.32 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.683 0.793 . . . . 72.45 109.998 173.555 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 52.4 m -74.94 -45.51 41.93 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 109.689 -0.485 . . . . 74.3 109.689 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -60.04 -49.89 75.87 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.166 0.986 . . . . 74.25 110.793 -176.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.49 HE21 ' HA ' ' A' ' 115' ' ' VAL . 36.4 tt0 -53.29 -59.2 4.87 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 124.395 1.059 . . . . 73.41 111.065 177.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 59.7 mt -72.94 -13.5 61.26 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 114.915 -1.039 . . . . 73.15 111.691 -172.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.36 -27.76 59.29 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.98 0.912 . . . . 74.41 111.143 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -87.41 -43.95 11.71 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.076 0.55 . . . . 75.44 109.571 173.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -178.13 159.21 24.61 Favored Glycine 0 C--N 1.344 0.983 0 CA-C-N 115.544 -0.753 . . . . 51.2 112.587 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -62.08 -29.0 70.01 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.402 1.081 . . . . 75.52 112.426 -178.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -59.9 140.69 56.49 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.233 1.013 . . . . 72.22 112.626 -172.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.49 ' HA ' HE21 ' A' ' 108' ' ' GLN . 8.6 p . . . . . 0 CA--C 1.544 0.718 0 N-CA-C 108.576 -0.898 . . . . 75.21 108.576 168.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 75.8 mt . . . . . 0 N--CA 1.468 0.464 0 N-CA-C 107.778 -1.193 . . . . 74.34 107.778 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -75.69 112.38 12.0 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.433 0.693 . . . . 72.12 109.877 -169.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 44.8 mm -119.97 112.23 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 107.717 -1.216 . . . . 73.12 107.717 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . 0.504 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.2 ttmm -91.99 126.55 37.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.932 0.893 . . . . 75.35 109.514 -173.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.9 m -90.28 120.6 31.56 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 108.837 -0.801 . . . . 75.41 108.837 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.7 mt -128.04 139.6 52.44 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.043 0.937 . . . . 71.52 109.071 -179.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 72.4 p -83.68 160.94 21.22 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.166 0.586 . . . . 74.44 110.192 177.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 43.1 p -115.77 162.25 26.36 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 108.664 -0.865 . . . . 74.21 108.664 175.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -58.37 -16.35 28.45 Favored 'Trans proline' 0 C--N 1.377 2.027 0 C-N-CA 122.844 2.363 . . . . 74.13 113.37 167.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . 0.459 ' HB3' ' HB2' ' A' ' 29' ' ' ALA . 28.0 t-20 -84.26 151.02 25.05 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.308 0.643 . . . . 64.52 110.723 176.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -67.04 -52.85 37.25 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 124.304 1.042 . . . . 62.13 112.594 -176.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -106.97 18.72 21.44 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.678 0.791 . . . . 75.42 111.253 -168.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . 0.459 ' HB2' ' HB3' ' A' ' 26' ' ' ASN . . . -111.94 128.34 56.13 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.535 0.734 . . . . 65.21 109.272 177.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.9 tp -137.56 116.23 12.16 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 107.296 -1.372 . . . . 75.32 107.296 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . 0.452 ' HA ' ' HA ' ' A' ' 85' ' ' THR . 60.9 pttt -94.87 150.07 20.57 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.442 0.639 . . . . 74.14 111.194 -176.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -124.32 122.52 37.94 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.569 1.147 . . . . 60.23 108.113 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.504 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 26.7 tp -104.12 126.64 51.39 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 124.003 0.921 . . . . 72.01 109.613 -165.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.5 p -85.24 106.56 16.75 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.424 0.689 . . . . 65.33 109.142 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.6 p -96.14 -8.42 33.27 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.385 0.674 . . . . 70.31 112.66 -170.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.32 -32.8 37.91 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.75 0.82 . . . . 74.15 112.858 -169.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 121.41 -23.1 7.68 Favored Glycine 0 N--CA 1.475 1.248 0 N-CA-C 111.048 -0.821 . . . . 74.03 111.048 -171.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -68.06 96.76 0.64 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.456 -0.942 . . . . 75.15 108.456 168.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.8 ttt -79.71 139.24 37.41 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.593 0.757 . . . . 73.43 109.194 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.575 HD23 HD21 ' A' ' 109' ' ' LEU . 87.9 mt -60.1 -34.55 73.63 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.202 0.601 . . . . 70.11 112.2 -178.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . 0.544 HE22 HD13 ' A' ' 48' ' ' ILE . 25.6 tt0 . . . . . 0 C--O 1.24 0.583 0 O-C-N 124.3 1.0 . . . . 73.13 109.672 -177.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 76.7 p . . . . . 0 N--CA 1.483 1.193 0 N-CA-C 110.146 -0.316 . . . . 63.03 110.146 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.36 73.14 1.44 Allowed 'General case' 0 N--CA 1.488 1.46 0 CA-C-O 121.432 0.634 . . . . 74.42 111.772 -174.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.2 m 51.85 69.33 0.68 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.286 1.034 . . . . 75.14 111.488 -178.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.544 HD13 HE22 ' A' ' 41' ' ' GLN . 57.6 mt -75.85 99.21 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.587 -0.523 . . . . 65.15 109.587 -175.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 94.0 t -80.25 124.2 37.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 108.196 -1.038 . . . . 65.42 108.196 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.7 mt -105.02 109.37 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 108.29 -1.004 . . . . 72.44 108.29 -179.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -79.6 140.2 37.22 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.736 -0.468 . . . . 74.34 109.736 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -65.75 -23.83 66.82 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.784 0.433 . . . . 75.55 111.388 176.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -85.58 -19.61 30.8 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.725 0.81 . . . . 61.21 111.791 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -92.35 95.39 9.65 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 108.572 -0.899 . . . . 73.23 108.572 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -53.08 -40.15 63.85 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.369 1.068 . . . . 72.23 113.023 178.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -67.43 -44.15 79.43 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.514 0.726 . . . . 73.31 112.162 -169.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 97.7 mt -61.84 -35.09 77.25 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.464 0.706 . . . . 72.21 111.31 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . 0.493 HG23 ' HG2' ' A' ' 65' ' ' GLN . 53.7 mt -77.71 -34.0 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 CA-C-N 115.068 -0.969 . . . . 75.53 110.205 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -59.62 -36.44 76.32 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.181 0.592 . . . . 74.31 111.268 174.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.7 m170 -74.75 -39.23 61.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.499 0.72 . . . . 74.53 111.117 178.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 43.7 t -104.45 98.78 8.51 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.431 0.692 . . . . 73.25 110.646 -176.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -61.13 -32.31 72.01 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.939 0.496 . . . . 73.5 110.659 173.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.0 tp -58.27 -40.33 81.56 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.024 0.93 . . . . 75.04 110.713 174.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.04 -40.93 91.42 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.209 0.604 . . . . 72.52 111.544 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.493 ' HG2' HG23 ' A' ' 58' ' ' ILE . 91.9 mt-30 -55.68 -47.08 77.35 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.901 0.751 . . . . 73.33 110.162 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -62.99 -51.03 68.44 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.956 -1.02 . . . . 72.31 112.84 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -65.05 -45.83 93.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.062 0.545 . . . . 64.35 111.291 -174.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -69.37 -33.06 72.49 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.791 0.436 . . . . 74.33 112.053 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 52.8 tp -70.99 -42.69 69.32 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.709 0.404 . . . . 74.43 111.192 177.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -74.95 -26.67 59.77 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.164 0.586 . . . . 72.44 111.475 -178.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.5 t -146.88 103.58 3.88 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 122.826 0.45 . . . . 74.03 110.074 178.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -78.73 7.23 4.36 Favored 'Trans proline' 0 C--N 1.373 1.866 0 C-N-CA 122.757 2.305 . . . . 63.54 112.928 173.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -78.51 -25.76 60.39 Favored Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.149 -0.38 . . . . 72.12 112.149 171.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.486 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 42.2 t -69.43 121.96 19.97 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.186 0.594 . . . . 71.52 110.167 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -74.49 -48.33 27.89 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.252 1.021 . . . . 74.24 110.538 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 62.0 p -162.81 166.42 24.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.607 -1.178 . . . . 72.31 110.326 -173.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.2 mt -111.69 169.86 8.54 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.0 -1.111 . . . . 75.32 108.0 171.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.527 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 56.0 ttm -143.14 115.43 8.46 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.517 -1.29 . . . . 72.35 107.517 170.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.529 HD12 HD12 ' A' ' 84' ' ' LEU . 42.7 mm -84.89 104.64 13.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 107.943 -1.132 . . . . 75.44 107.943 179.333 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -85.46 173.31 47.75 Favored Glycine 0 C--O 1.244 0.751 0 N-CA-C 109.442 -1.463 . . . . 74.01 109.442 167.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.32 -52.39 64.88 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.224 0.61 . . . . 64.22 110.724 -176.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -123.96 5.06 8.67 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 115.368 -0.833 . . . . 75.24 111.879 -176.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -140.2 133.92 30.41 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.982 0.513 . . . . 74.1 110.379 -175.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.642 HD23 HD12 ' A' ' 105' ' ' LEU . 32.8 tp -103.27 114.61 29.03 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 109.445 -0.576 . . . . 75.41 109.445 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.527 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 18.4 m -97.81 113.27 25.02 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.35 0.66 . . . . 74.42 109.558 -177.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.577 HG13 HD11 ' A' ' 101' ' ' ILE . 30.1 mm -89.01 128.35 41.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 108.307 -0.997 . . . . 75.33 108.307 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -117.94 110.94 18.33 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 108.366 -0.976 . . . . 74.13 108.366 -177.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -117.26 174.28 6.21 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.053 0.541 . . . . 72.41 111.332 -174.467 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -74.02 131.71 41.65 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 108.511 -0.922 . . . . 72.03 108.511 172.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -56.35 -30.37 62.56 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.958 1.096 . . . . 73.3 113.958 -172.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.7 mtp -76.79 -9.33 58.6 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.98 0.512 . . . . 73.41 112.228 -176.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 39.6 t -95.77 138.62 20.86 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.323 1.049 . . . . 73.01 108.475 176.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -79.46 160.5 26.56 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.349 0.66 . . . . 75.34 111.165 -176.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 22.7 m95 -80.3 -51.87 8.38 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.115 0.566 . . . . 72.23 112.124 176.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -60.9 -18.19 55.05 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.786 0.834 . . . . 72.42 112.663 -171.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.9 m -71.46 -49.68 39.1 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.335 0.654 . . . . 63.13 110.717 175.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 6.7 mt -85.23 -31.1 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 CA-C-N 115.234 -0.893 . . . . 73.23 111.043 -173.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.2 ttpm? -53.66 -50.11 85.18 Favored Pre-proline 0 CA--C 1.559 1.309 0 C-N-CA 124.566 1.146 . . . . 74.43 113.993 -167.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -58.96 -35.86 97.85 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 122.014 1.81 . . . . 75.33 112.329 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.93 -37.86 82.18 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.601 -0.727 . . . . 74.11 110.668 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.577 HD11 HG13 ' A' ' 86' ' ' ILE . 69.3 mt -65.51 -54.05 32.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 123.676 0.79 . . . . 73.11 109.677 177.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 87.3 mt -54.32 -39.34 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 124.053 0.941 . . . . 74.42 111.317 -177.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.13 -49.1 75.74 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 115.087 -0.96 . . . . 72.15 111.3 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.0 mt -65.49 -33.46 76.0 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.75 0.82 . . . . 71.0 112.471 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.642 HD12 HD23 ' A' ' 84' ' ' LEU . 9.7 mp -71.78 -27.26 62.83 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.251 0.62 . . . . 60.4 111.324 175.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.1 m -72.28 -32.47 66.65 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 109.379 -0.601 . . . . 73.13 109.379 173.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.443 ' HA ' ' HE2' ' A' ' 107' ' ' LYS . 9.1 mmpt? -69.28 -45.62 69.21 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.454 0.701 . . . . 75.42 111.105 177.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.519 HE21 ' HB ' ' A' ' 115' ' ' VAL . 1.1 tm0? -61.12 -54.24 47.02 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.902 0.881 . . . . 72.1 109.314 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . 0.575 HD21 HD23 ' A' ' 40' ' ' LEU . 97.7 mt -74.37 -14.67 60.9 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 114.729 -1.123 . . . . 74.25 112.26 -174.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.59 -35.81 78.89 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.993 0.517 . . . . 72.35 110.355 171.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . 0.481 ' HB2' ' HG2' ' A' ' 113' ' ' GLU . 93.0 m-85 -87.09 -34.6 19.08 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.486 -0.779 . . . . 72.41 109.713 171.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 79.78 52.02 4.87 Favored Glycine 0 C--N 1.349 1.292 0 N-CA-C 110.685 -0.966 . . . . 54.11 110.685 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . 0.481 ' HG2' ' HB2' ' A' ' 111' ' ' TYR . 32.5 mm-40 -82.35 154.73 25.11 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.521 0.728 . . . . 75.34 112.412 -172.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -89.05 98.72 11.92 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 106.202 -1.777 . . . . 73.24 106.202 159.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . 0.519 ' HB ' HE21 ' A' ' 108' ' ' GLN . 3.5 p . . . . . 0 N--CA 1.487 1.413 0 C-N-CA 125.653 1.581 . . . . 75.21 114.677 -168.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.414 ' H ' HG23 ' A' ' 106' ' ' THR . 85.6 mt . . . . . 0 C--O 1.237 0.443 0 N-CA-C 109.431 -0.581 . . . . 75.52 109.431 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -67.61 127.98 34.74 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 114.591 -1.186 . . . . 74.22 109.761 -173.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.1 mm -119.95 118.71 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 106.491 -1.67 . . . . 75.22 106.491 -175.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -95.06 129.75 42.03 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.23 -1.026 . . . . 74.42 108.23 -175.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.6 t -100.56 130.86 46.68 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.489 0.716 . . . . 75.34 109.379 -178.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.1 mt -126.67 138.82 53.47 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.377 1.071 . . . . 74.23 108.668 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 40.1 p -73.71 149.2 42.01 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.458 0.703 . . . . 61.03 110.897 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.6 p -122.89 167.57 14.15 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.819 1.248 . . . . 74.55 108.028 -176.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.78 -18.19 26.1 Favored 'Trans proline' 0 C--N 1.39 2.735 0 C-N-CA 122.364 2.042 . . . . 71.34 113.426 177.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -109.61 133.24 53.33 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.602 0.761 . . . . 71.4 109.466 176.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.33 -21.76 62.88 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.283 0.633 . . . . 71.13 110.185 166.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -59.95 -47.23 86.65 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.608 1.563 . . . . 73.03 110.469 173.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.55 160.52 15.0 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 114.3 -1.318 . . . . 71.13 110.181 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.0 tp -158.18 128.55 6.17 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.787 -0.82 . . . . 75.03 108.787 173.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -82.37 127.01 32.83 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.988 0.915 . . . . 73.23 110.358 -176.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' PHE . . . . . 0.442 ' CZ ' ' HG3' ' A' ' 98' ' ' LYS . 80.1 m-85 -114.75 116.71 29.09 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.562 1.145 . . . . 73.54 108.344 175.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.0 tp -114.8 129.96 56.78 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 124.069 0.948 . . . . 74.34 109.33 -169.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.8 t -100.02 103.87 15.43 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 108.126 -1.064 . . . . 42.35 108.126 174.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.0 p -104.24 -6.61 20.76 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.096 0.958 . . . . 73.42 109.754 176.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.85 -60.42 3.68 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 124.648 1.179 . . . . 70.3 111.725 -168.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -161.1 -81.54 0.04 OUTLIER Glycine 0 C--N 1.338 0.678 0 N-CA-C 111.114 -0.794 . . . . 53.23 111.114 176.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.21 119.91 17.08 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.471 0.708 . . . . 65.13 109.659 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 48.4 ttp -97.38 155.61 16.83 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.04 -0.982 . . . . 75.21 109.332 -176.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.1 mt -58.68 -62.29 1.97 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.115 1.154 . . . . 75.4 114.115 -169.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 . . . . . 0 N--CA 1.484 1.235 0 CA-C-O 119.233 -0.413 . . . . 75.33 110.693 -174.086 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.1 t . . . . . 0 CA--C 1.548 0.897 0 CA-C-O 121.009 0.433 . . . . 75.2 110.623 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.06 -179.02 5.16 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.185 0.994 . . . . 74.54 109.635 176.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.8 m -74.61 93.98 2.6 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.435 0.694 . . . . 74.11 110.604 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.499 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 46.6 mt -81.44 97.07 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 N-CA-C 109.126 -0.694 . . . . 71.53 109.126 175.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.1 t -84.21 107.87 15.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 108.48 -0.933 . . . . 62.42 108.48 -178.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . 0.508 HG22 ' HB2' ' A' ' 57' ' ' LEU . 55.5 mt -105.61 109.51 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 107.138 -1.43 . . . . 75.12 107.138 174.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -93.48 171.62 8.79 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.507 -0.553 . . . . 71.35 109.507 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -56.75 -25.74 55.61 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.248 1.019 . . . . 75.43 112.638 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.8 t -87.12 -17.07 33.64 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.031 0.932 . . . . 73.22 111.466 -178.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -84.17 60.09 5.72 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.407 0.683 . . . . 74.14 110.43 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -61.27 -24.54 66.46 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.278 1.031 . . . . 72.54 111.577 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -56.18 -51.87 66.44 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.851 0.861 . . . . 73.11 110.218 172.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.508 ' HB2' HG22 ' A' ' 50' ' ' ILE . 21.8 mt -78.58 -34.95 46.5 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 114.312 -1.313 . . . . 74.33 110.194 -172.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 78.5 mt -62.88 -47.43 92.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.86 0.864 . . . . 73.2 110.619 176.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -66.29 -15.63 63.37 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.823 0.675 . . . . 63.05 112.823 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -87.64 -8.86 55.65 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.726 0.411 . . . . 71.55 111.955 173.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.1 t -130.39 102.18 6.07 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.579 0.752 . . . . 75.44 109.175 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -58.49 -28.37 65.33 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.106 0.562 . . . . 73.32 110.627 176.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.609 ' HB2' ' NE2' ' A' ' 108' ' ' GLN . 40.2 tp -62.35 -48.06 81.48 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.501 0.501 . . . . 73.45 110.358 174.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.81 -45.33 90.18 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 124.075 0.859 . . . . 75.11 110.075 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -57.74 -44.31 85.98 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 124.357 1.036 . . . . 74.13 111.018 178.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.414 ' HB3' HD22 ' A' ' 104' ' ' LEU . 17.8 mm100 -68.31 -36.32 79.15 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.339 0.656 . . . . 73.15 112.308 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 93.3 mt -67.77 -46.79 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.077 0.551 . . . . 72.43 109.984 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -71.4 -21.73 61.96 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 123.272 0.629 . . . . 64.21 111.694 176.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.11 -53.1 7.76 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.265 0.626 . . . . 74.45 110.491 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -84.95 -17.74 36.78 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.541 -0.754 . . . . 74.34 111.525 -174.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' CYS . . . . . 0.479 ' SG ' HG21 ' A' ' 97' ' ' ILE . 62.2 m -141.34 90.13 9.18 Favored Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 123.251 0.621 . . . . 55.31 109.602 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -75.31 -1.6 11.5 Favored 'Trans proline' 0 C--N 1.374 1.905 0 C-N-CA 122.784 2.323 . . . . 73.21 113.1 178.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.07 -22.58 77.68 Favored Glycine 0 C--N 1.351 1.388 0 N-CA-C 111.692 -0.563 . . . . 73.44 111.692 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.2 t -65.79 121.56 15.09 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 C-N-CA 123.74 0.816 . . . . 65.11 110.098 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -91.08 -40.34 11.67 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.334 1.054 . . . . 63.21 110.436 -176.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.2 t -154.18 160.52 41.91 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.595 0.712 . . . . 61.31 111.501 -175.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 mt -126.65 138.21 53.39 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.053 1.741 . . . . 75.24 106.803 174.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' MET . . . . . 0.436 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 49.9 ttm -116.66 104.63 11.57 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 108.311 -0.996 . . . . 73.23 108.311 172.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ILE . . . . . 0.723 HD12 HD13 ' A' ' 84' ' ' LEU . 10.6 mm -84.01 112.37 21.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 107.778 -1.193 . . . . 73.04 107.778 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -96.95 -158.2 31.19 Favored Glycine 0 C--O 1.242 0.627 0 N-CA-C 111.754 -0.538 . . . . 61.4 111.754 177.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.56 -62.1 1.52 Allowed 'General case' 0 C--O 1.244 0.77 0 C-N-CA 123.796 0.838 . . . . 72.24 109.301 174.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.87 -29.81 12.75 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 113.858 -1.519 . . . . 74.34 111.05 -174.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -114.64 173.19 6.59 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.275 -0.875 . . . . 72.55 113.182 -160.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LEU . . . . . 0.723 HD13 HD12 ' A' ' 79' ' ' ILE . 14.7 tp -144.79 117.4 8.62 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.576 1.55 . . . . 74.04 107.719 175.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 11.3 m -103.62 109.52 21.24 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.914 -0.773 . . . . 71.42 108.914 -175.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . 0.567 HG13 HD12 ' A' ' 101' ' ' ILE . 18.6 mm -88.46 117.28 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 108.708 -0.849 . . . . 65.44 108.708 -176.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -101.96 128.74 48.24 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 107.79 -1.189 . . . . 72.45 107.79 174.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.83 169.91 16.96 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.659 0.384 . . . . 70.33 110.389 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.18 126.81 28.62 Favored 'General case' 0 C--N 1.35 0.609 0 N-CA-C 109.236 -0.654 . . . . 64.1 109.236 178.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.6 ptm85 -65.41 -23.17 66.88 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.475 0.917 . . . . 75.52 113.475 -169.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.6 mmt -79.19 -21.49 46.29 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.921 0.488 . . . . 74.24 110.937 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.0 t -88.02 145.57 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 108.08 -1.082 . . . . 74.44 108.08 174.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -106.95 144.06 34.14 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 112.895 0.702 . . . . 73.41 112.895 -167.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -61.72 -22.99 65.84 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.543 1.137 . . . . 74.32 112.199 174.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -53.42 -32.9 51.79 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.397 1.079 . . . . 74.34 112.119 -178.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.7 t -103.45 -20.79 13.93 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.859 0.864 . . . . 74.53 111.579 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' ILE . . . . . 0.479 HG21 ' SG ' ' A' ' 71' ' ' CYS . 55.5 mt -97.48 -53.65 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 122.886 0.474 . . . . 73.1 111.344 -170.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' LYS . . . . . 0.442 ' HG3' ' CZ ' ' A' ' 32' ' ' PHE . 3.8 ttpm? -52.48 -47.77 92.3 Favored Pre-proline 0 N--CA 1.49 1.565 0 N-CA-C 114.026 1.121 . . . . 75.3 114.026 -173.053 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.33 -40.98 82.71 Favored 'Trans proline' 0 C--N 1.394 2.972 0 C-N-CA 122.121 1.881 . . . . 75.14 112.205 177.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLU . . . . . 0.438 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 11.2 mm-40 -69.58 -38.05 77.19 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 115.483 -0.781 . . . . 70.34 110.36 -177.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.567 HD12 HG13 ' A' ' 86' ' ' ILE . 86.2 mt -60.1 -52.28 63.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.31 0.644 . . . . 73.01 110.322 176.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 79.6 mt -56.91 -39.24 63.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.462 0.705 . . . . 74.13 111.026 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -64.25 -42.35 96.54 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.147 0.979 . . . . 74.23 111.33 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . 0.491 HD21 ' HE2' ' A' ' 107' ' ' LYS . 89.6 mt -64.7 -43.67 92.74 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.497 0.719 . . . . 72.14 110.765 176.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' LEU . . . . . 0.604 HD12 HD13 ' A' ' 63' ' ' LEU . 11.0 mp -66.88 -24.9 66.17 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.728 0.811 . . . . 73.4 111.164 178.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' THR . . . . . 0.414 HG23 ' H ' ' A' ' 17' ' ' ILE . 82.9 m -77.39 -48.93 16.0 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.448 0.699 . . . . 65.52 110.42 178.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' LYS . . . . . 0.583 ' HZ2' ' HB3' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -68.14 -40.36 82.47 Favored 'General case' 0 C--N 1.358 0.968 0 O-C-N 123.337 0.398 . . . . 74.51 110.969 -174.16 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' GLN . . . . . 0.609 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 20.7 tt0 -55.84 -58.71 6.73 Favored 'General case' 0 C--N 1.358 0.938 0 O-C-N 123.916 0.76 . . . . 71.33 110.35 177.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 86.8 mt -71.64 -10.8 60.31 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 114.841 -1.072 . . . . 72.44 111.764 -173.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.71 -37.1 70.69 Favored 'General case' 0 C--N 1.354 0.801 0 C-N-CA 123.269 0.628 . . . . 72.01 111.173 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -110.39 -19.14 13.06 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.143 0.577 . . . . 74.42 111.953 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -119.8 163.11 13.8 Favored Glycine 0 C--N 1.339 0.729 0 N-CA-C 111.016 -0.834 . . . . 63.12 111.016 -176.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -102.88 -24.19 13.7 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.356 0.662 . . . . 73.01 110.168 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -114.27 158.84 20.87 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.787 0.835 . . . . 75.2 111.474 -167.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 5.8 p . . . . . 0 CA--C 1.552 1.037 0 C-N-CA 123.891 0.877 . . . . 74.13 111.123 174.829 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.3 mtp . . . . . 0 N--CA 1.483 1.211 0 N-CA-C 110.119 -0.326 . . . . 75.14 110.119 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 158.65 77.1 0.02 OUTLIER Glycine 0 C--N 1.348 1.238 0 N-CA-C 112.121 -0.392 . . . . 61.22 112.121 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -66.12 99.4 0.51 Allowed 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.57 0.7 . . . . 64.54 110.207 175.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 47.1 t60 -119.26 -0.98 10.89 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.0 0.52 . . . . 64.52 111.293 -176.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -66.05 140.96 58.3 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.668 0.387 . . . . 75.32 110.345 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -155.04 154.97 33.28 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.091 0.556 . . . . 73.11 110.045 -174.471 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -139.56 134.97 32.9 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.805 -0.813 . . . . 73.3 108.805 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -109.11 148.44 30.86 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 122.955 0.502 . . . . 75.54 110.837 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.9 t -75.28 171.79 13.58 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.96 0.904 . . . . 64.53 111.083 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -92.05 120.01 32.27 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.096 0.558 . . . . 72.15 110.87 -174.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 17.7 ptp -111.06 86.45 2.32 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 107.94 -1.133 . . . . 73.32 107.94 169.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -104.26 171.58 7.26 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 114.712 -1.131 . . . . 74.33 111.297 -171.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -103.3 10.66 37.44 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.13 0.972 . . . . 71.55 110.522 176.16 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -108.28 96.5 6.4 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.053 0.941 . . . . 71.13 109.42 -176.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 -78.63 6.16 9.42 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 113.639 0.977 . . . . 71.54 113.639 -176.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -129.99 140.13 50.94 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 109.112 -0.699 . . . . 75.14 109.112 175.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.9 mt -120.11 117.13 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 107.478 -1.305 . . . . 72.52 107.478 177.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -64.88 124.7 22.7 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 123.75 0.656 . . . . 74.42 109.725 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.438 ' HB ' HG22 ' A' ' 102' ' ' ILE . 50.3 mm -116.03 127.37 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 N-CA-C 107.313 -1.366 . . . . 73.53 107.313 -174.188 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -93.63 150.13 20.67 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 108.494 -0.928 . . . . 74.3 108.494 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.9 t -141.28 112.23 7.22 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.695 0.798 . . . . 75.24 109.233 173.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.8 mt -99.65 138.97 35.99 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 124.075 0.95 . . . . 72.32 110.33 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.0 p -80.22 140.2 36.38 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 123.748 0.655 . . . . 72.34 109.453 176.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 63.9 p -107.09 166.08 11.7 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.539 1.136 . . . . 73.34 108.712 -176.676 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.71 -7.93 19.67 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.375 2.05 . . . . 75.12 112.743 169.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -82.65 151.14 26.42 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.222 1.009 . . . . 74.33 111.628 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -89.4 -31.58 17.68 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.086 0.954 . . . . 72.12 112.357 -171.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -121.82 2.3 9.99 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.269 0.627 . . . . 75.31 111.921 -174.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -112.54 137.53 50.64 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.91 0.484 . . . . 64.05 110.121 177.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.4 tp -136.99 134.59 36.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.993 0.517 . . . . 72.53 109.958 177.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.578 ' HE2' HD11 ' A' ' 33' ' ' LEU . 88.6 tttt -92.2 120.34 32.68 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.296 1.038 . . . . 73.53 110.629 -175.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -109.81 109.04 19.58 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.296 -1.002 . . . . 73.32 108.296 173.025 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.578 HD11 ' HE2' ' A' ' 31' ' ' LYS . 4.5 tt -111.94 134.18 53.66 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.366 -0.976 . . . . 75.52 108.366 -175.146 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.3 m -85.93 111.96 20.73 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.278 0.631 . . . . 63.25 110.006 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.501 HG22 HD22 ' A' ' 33' ' ' LEU . 26.3 p -135.21 90.94 2.68 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.838 0.855 . . . . 74.13 110.284 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -174.26 -58.59 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.168 0.587 . . . . 65.2 110.717 176.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.53 -72.32 0.03 OUTLIER Glycine 0 C--N 1.342 0.912 0 CA-C-N 115.695 -0.684 . . . . 72.01 111.528 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.42 ' HB2' ' HB3' ' A' ' 109' ' ' LEU . 25.0 mm-40 -99.74 167.1 10.77 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.182 0.515 . . . . 71.34 111.195 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.442 ' HE1' ' HG3' ' A' ' 43' ' ' ARG . 24.1 ptm -131.44 167.66 18.94 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.07 1.348 . . . . 72.13 108.672 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 90.2 mt -75.51 -66.69 0.74 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 122.738 0.415 . . . . 75.3 111.191 -173.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -121.53 136.59 54.94 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.264 0.626 . . . . 73.32 109.426 -172.018 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 5.3 p -59.18 135.55 57.67 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 122.928 0.491 . . . . 74.14 111.667 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.442 ' HG3' ' HE1' ' A' ' 39' ' ' MET . 95.9 mtt180 -63.74 129.73 41.32 Favored 'General case' 0 C--N 1.35 0.618 0 C-N-CA 123.685 0.794 . . . . 73.14 111.194 -177.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.35 1.57 18.26 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.486 -0.779 . . . . 61.1 111.645 -175.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.3 m -98.22 -174.81 2.94 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.806 0.843 . . . . 72.44 110.097 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 23.1 pttm -109.26 162.06 14.66 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.743 0.417 . . . . 75.34 110.712 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 79' ' ' ILE . 17.9 p -83.37 97.01 8.71 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.393 0.677 . . . . 74.24 109.555 175.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 56.9 mt -86.06 121.2 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.919 0.888 . . . . 74.03 110.58 -174.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -89.5 108.65 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 N-CA-C 109.591 -0.522 . . . . 74.23 109.591 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 60.7 mt -97.16 110.2 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.915 -0.772 . . . . 71.22 108.915 -176.746 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -93.74 151.93 19.29 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.288 0.635 . . . . 72.14 110.059 -175.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.436 ' HA ' HD11 ' A' ' 58' ' ' ILE . 9.1 p30 -66.36 -22.68 66.26 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.722 0.409 . . . . 71.4 111.483 178.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.4 p -83.35 -32.81 26.05 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.578 0.751 . . . . 72.05 110.726 176.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.4 75.06 9.84 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.816 0.846 . . . . 75.42 109.513 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -64.52 -28.58 69.75 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 114.625 -1.17 . . . . 74.43 113.588 -172.038 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -60.69 -38.29 84.5 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.584 0.629 . . . . 74.31 110.814 -179.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 78.5 mt -69.78 -38.5 76.73 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.421 0.688 . . . . 74.52 110.953 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.482 HG23 ' HG2' ' A' ' 65' ' ' GLN . 52.2 mt -62.65 -46.26 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.939 0.896 . . . . 74.11 110.246 175.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -58.86 -31.41 68.52 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.645 1.178 . . . . 63.23 111.692 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -70.36 -34.29 72.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.248 0.619 . . . . 74.41 111.463 177.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.517 ' HB2' HG12 ' A' ' 116' ' ' ILE . 39.2 t -113.17 105.04 12.97 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.479 0.712 . . . . 70.2 110.154 -175.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -56.98 -31.89 65.51 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.414 0.686 . . . . 72.4 110.748 174.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.465 HD11 HD12 ' A' ' 105' ' ' LEU . 43.9 tp -63.14 -44.52 95.31 Favored 'General case' 0 C--N 1.348 0.538 0 C-N-CA 124.095 0.958 . . . . 74.22 110.535 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.71 97.06 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 123.272 0.629 . . . . 71.02 110.698 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.482 ' HG2' HG23 ' A' ' 58' ' ' ILE . 68.9 mt-30 -56.93 -44.53 82.57 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 124.355 1.035 . . . . 71.24 110.846 177.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -68.32 -36.78 79.81 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.434 0.693 . . . . 73.01 111.987 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 81.3 mt -68.72 -48.67 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.28 0.632 . . . . 75.41 111.027 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -66.97 -30.6 70.77 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.693 0.397 . . . . 72.3 111.289 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.5 tp -72.37 -52.41 16.19 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.198 0.599 . . . . 75.32 111.291 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -85.02 -29.23 25.14 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.629 0.771 . . . . 75.35 111.937 -172.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 58.9 m -118.98 87.35 33.73 Favored Pre-proline 0 CA--C 1.544 0.749 0 N-CA-C 107.72 -1.215 . . . . 70.15 107.72 177.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.07 -17.77 45.78 Favored 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 123.11 2.54 . . . . 75.41 113.456 -172.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.5 -12.89 83.96 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-O 119.14 -0.811 . . . . 73.04 114.364 -177.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.4 t -70.64 123.32 24.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-N 117.491 0.646 . . . . 70.5 110.7 -175.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -81.22 -50.78 9.16 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.693 1.197 . . . . 74.22 110.168 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 56.7 p -157.62 163.65 38.05 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 114.637 -1.165 . . . . 72.34 110.911 -173.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.4 mt -119.27 164.94 14.9 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 124.761 1.224 . . . . 73.13 108.533 177.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.562 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 56.0 ttm -138.33 108.43 6.4 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 107.982 -1.118 . . . . 75.31 107.982 166.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.706 HD12 HD11 ' A' ' 84' ' ' LEU . 23.0 mm -83.81 102.05 9.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 108.465 -0.939 . . . . 70.24 108.465 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.38 -173.69 48.43 Favored Glycine 0 C--O 1.241 0.574 0 N-CA-C 110.511 -1.036 . . . . 74.23 110.511 173.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.74 -63.49 1.05 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.159 -0.682 . . . . 71.44 109.159 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -95.57 -21.59 18.16 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.025 0.53 . . . . 72.54 111.563 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -120.13 169.68 10.01 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.738 0.644 . . . . 74.34 112.738 -168.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.706 HD11 HD12 ' A' ' 79' ' ' ILE . 18.0 tp -142.79 117.64 9.92 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.164 1.386 . . . . 72.41 107.827 176.599 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.562 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 58.4 m -96.95 109.69 22.38 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.811 -0.811 . . . . 72.22 108.811 -177.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 25.8 mm -89.33 124.13 41.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.448 -0.945 . . . . 64.0 108.448 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -109.86 127.95 55.03 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.394 -1.336 . . . . 64.3 107.394 175.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.496 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -130.8 172.29 12.17 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.79 0.436 . . . . 74.32 110.093 -176.874 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 12.5 t70 -81.44 141.94 33.42 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 109.01 -0.737 . . . . 74.15 109.01 172.29 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -66.35 -10.88 47.44 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 113.581 0.956 . . . . 72.31 113.581 -172.343 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' MET . . . . . 0.413 ' HG3' HG22 ' A' ' 92' ' ' VAL . 24.1 ptm -76.04 -28.04 57.52 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.174 0.443 . . . . 73.42 111.144 175.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.413 HG22 ' HG3' ' A' ' 91' ' ' MET . 40.9 t -99.1 127.29 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 109.051 -0.722 . . . . 75.11 109.051 -175.717 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -95.3 154.12 17.35 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.35 0.66 . . . . 75.43 111.129 -173.016 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.496 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 97.2 m95 -68.04 -13.78 62.46 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.19 0.996 . . . . 73.31 112.598 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -52.5 -35.0 52.02 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.115 0.966 . . . . 75.1 111.876 175.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.4 t -97.26 -32.79 11.73 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.315 0.646 . . . . 74.14 110.826 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 65.1 mt -80.55 -51.27 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 123.509 0.724 . . . . 72.01 110.857 -166.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.456 ' HG3' ' HB3' ' A' ' 94' ' ' TRP . 59.8 mtpt -54.85 -58.45 14.46 Favored Pre-proline 0 N--CA 1.484 1.246 0 CA-C-O 117.583 -1.199 . . . . 74.31 113.064 -174.034 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -59.73 -36.25 92.24 Favored 'Trans proline' 0 C--N 1.398 3.135 0 C-N-CA 121.804 1.669 . . . . 62.34 112.203 -171.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.403 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 53.5 mt-10 -64.91 -46.43 81.74 Favored 'General case' 0 C--N 1.35 0.598 0 O-C-N 123.96 0.788 . . . . 71.34 110.272 177.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.33 -32.18 49.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 123.456 0.703 . . . . 75.21 111.888 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.448 HG12 ' O ' ' A' ' 98' ' ' LYS . 45.0 mm -62.99 -44.0 99.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 N-CA-C 109.165 -0.68 . . . . 72.23 109.165 175.036 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.56 -50.94 70.63 Favored 'General case' 0 C--N 1.354 0.783 0 CA-C-N 114.989 -1.005 . . . . 74.34 110.421 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.403 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 96.0 mt -61.85 -39.68 92.7 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.095 0.958 . . . . 72.34 111.567 -177.039 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.465 HD12 HD11 ' A' ' 63' ' ' LEU . 7.6 mp -64.73 -37.39 87.45 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.297 0.639 . . . . 74.13 110.812 176.569 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 85.4 m -71.8 -34.09 69.08 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.812 0.445 . . . . 75.23 109.978 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -67.41 -47.49 70.13 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 123.515 0.726 . . . . 75.42 109.994 176.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -48.24 81.29 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 124.22 0.95 . . . . 73.33 109.995 -175.356 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.42 ' HB3' ' HB2' ' A' ' 38' ' ' GLU . 67.3 mt -68.2 -14.24 62.83 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.916 0.76 . . . . 74.34 112.19 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -89.46 -22.15 22.63 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.542 0.737 . . . . 71.2 111.379 174.388 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -90.51 -51.98 5.13 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.229 0.538 . . . . 75.15 110.554 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -142.5 146.98 18.31 Favored Glycine 0 C--N 1.343 0.954 0 CA-C-N 114.974 -1.012 . . . . 62.35 111.835 -175.707 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -77.64 -34.58 53.14 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.591 0.756 . . . . 74.15 111.026 -174.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -97.7 138.82 34.5 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.002 0.521 . . . . 62.3 109.667 170.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.587 HG11 HG13 ' A' ' 116' ' ' ILE . 3.7 p -67.53 -42.75 87.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 123.781 0.832 . . . . 74.34 111.304 -178.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.587 HG13 HG11 ' A' ' 115' ' ' VAL . 54.0 mt -117.54 135.29 58.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 123.268 0.627 . . . . 74.32 109.451 -175.773 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.3 m -62.71 109.07 1.3 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 106.465 -1.68 . . . . 72.32 106.465 163.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -53.69 88.63 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 114.262 1.208 . . . . 74.3 114.262 -154.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 . . . . . 0 CA--C 1.56 1.337 0 C-N-CA 125.688 1.595 . . . . 74.43 112.131 170.248 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.486 1.356 0 N-CA-C 110.275 -0.268 . . . . 73.23 110.275 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -150.91 131.34 3.49 Favored Glycine 0 C--N 1.349 1.262 0 N-CA-C 111.799 -0.52 . . . . 73.52 111.799 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 -128.94 80.33 1.96 Allowed 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 108.088 -1.078 . . . . 74.32 108.088 175.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -83.96 109.93 18.01 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 115.584 -0.735 . . . . 74.41 109.9 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.8 p80 -150.92 84.35 1.34 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.587 0.755 . . . . 75.43 110.04 177.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -161.59 87.65 0.69 Allowed 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.28 -0.873 . . . . 74.33 109.432 174.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -124.45 98.17 5.63 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 108.426 -0.953 . . . . 72.51 108.426 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -107.18 114.0 27.77 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.552 0.741 . . . . 74.11 109.867 -177.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.8 t -121.86 163.38 19.31 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.575 0.75 . . . . 74.44 109.501 175.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.0 p-80 -149.78 147.63 28.24 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.218 -0.66 . . . . 74.42 109.218 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 41.8 tpp -160.94 119.99 2.58 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.291 0.567 . . . . 75.43 110.622 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -129.36 99.35 5.17 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 106.214 -1.772 . . . . 73.1 106.214 168.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.8 t -122.49 45.86 2.27 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 108.017 -1.105 . . . . 72.0 108.017 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -84.2 33.32 0.5 Allowed 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 114.789 -1.096 . . . . 74.22 112.758 -174.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.51 117.61 10.49 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.166 -1.05 . . . . 74.52 108.166 165.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.44 143.44 57.11 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 109.431 -0.581 . . . . 73.24 109.431 173.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.1 mt -95.65 115.9 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 O-C-N 123.569 0.543 . . . . 73.4 111.608 -162.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -95.2 145.73 24.83 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.674 0.79 . . . . 73.13 109.018 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.0 mm -129.03 126.78 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 106.75 -1.574 . . . . 74.45 106.75 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -105.75 125.73 51.33 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.311 -0.996 . . . . 73.15 108.311 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.9 t -102.57 113.15 26.27 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 109.101 -0.704 . . . . 61.11 109.101 -177.594 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.8 mt -101.3 140.55 35.44 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.579 0.752 . . . . 71.51 110.321 177.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 28.0 p -85.34 157.69 20.47 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.005 0.522 . . . . 74.44 111.211 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.3 p -126.72 161.48 52.86 Favored Pre-proline 0 CA--C 1.558 1.283 0 C-N-CA 124.762 1.225 . . . . 71.44 108.305 -177.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -61.53 -17.92 56.74 Favored 'Trans proline' 0 C--N 1.383 2.364 0 C-N-CA 122.23 1.953 . . . . 62.04 113.526 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -101.29 132.41 46.83 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 108.684 -0.858 . . . . 72.41 108.684 175.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.09 -16.6 56.52 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.563 0.345 . . . . 61.14 111.918 -176.854 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -70.6 -38.75 74.04 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 109.41 -0.589 . . . . 72.12 109.41 175.044 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.48 144.62 26.63 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.499 0.72 . . . . 74.12 110.67 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.5 tp -154.94 124.29 6.38 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.211 -0.663 . . . . 74.01 109.211 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -83.63 121.37 27.16 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.766 0.826 . . . . 74.31 110.837 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -109.4 112.73 25.02 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.299 1.04 . . . . 74.42 108.468 168.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.2 tp -105.01 134.48 48.04 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.27 1.028 . . . . 72.55 109.352 -176.28 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.4 p -74.91 105.25 5.85 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 108.54 -0.911 . . . . 71.14 108.54 172.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.6 m -107.97 39.97 1.84 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.473 1.109 . . . . 74.21 110.025 -168.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -137.16 -156.14 0.67 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.043 -0.98 . . . . 63.14 108.548 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -72.87 -20.62 79.91 Favored Glycine 0 C--N 1.352 1.423 0 CA-C-N 118.295 0.498 . . . . 70.41 113.352 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -94.76 158.7 15.39 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 121.31 0.576 . . . . 74.34 111.633 -176.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.5 ttt -134.25 150.97 51.06 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.604 1.162 . . . . 74.15 109.128 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.542 ' O ' ' HB3' ' A' ' 114' ' ' ASP . 94.1 mt -78.77 -58.07 3.43 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.86 0.689 . . . . 74.41 112.86 -175.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -116.28 -106.11 0.39 Allowed 'General case' 0 N--CA 1.48 1.07 0 O-C-N 121.591 -0.693 . . . . 72.34 109.731 -177.352 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 10.7 t -169.64 143.64 2.76 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 108.704 -0.85 . . . . 62.33 108.704 -176.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -70.43 114.26 8.37 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 107.948 -1.13 . . . . 74.24 107.948 -177.4 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.92 63.52 1.05 Allowed Glycine 0 C--N 1.336 0.533 0 N-CA-C 110.499 -1.04 . . . . 74.45 110.499 -175.457 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.4 t -136.21 -171.94 3.01 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.086 0.554 . . . . 74.12 109.822 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -93.35 142.59 27.15 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.073 0.949 . . . . 73.35 108.669 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.4 m -79.36 83.28 5.41 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 108.726 -0.842 . . . . 71.4 108.726 172.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 52.5 mt -73.93 99.58 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 CA-C-N 115.536 -0.756 . . . . 71.54 109.956 -170.554 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.416 ' HA ' ' O ' ' A' ' 77' ' ' LEU . 40.0 t -96.31 107.61 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 108.907 -0.775 . . . . 72.04 108.907 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.404 HG22 ' HB2' ' A' ' 57' ' ' LEU . 71.9 mt -105.18 113.46 42.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.436 1.094 . . . . 64.54 108.401 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.506 ' HZ2' ' HB2' ' A' ' 51' ' ' LYS . 10.6 mtmp? -80.2 161.53 25.15 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 108.862 -0.792 . . . . 73.02 108.862 176.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -64.09 -18.38 64.34 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.668 0.787 . . . . 74.31 111.935 178.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 74.1 p -74.9 -27.77 60.36 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.52 1.128 . . . . 73.51 112.08 175.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.89 69.35 10.55 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.792 0.837 . . . . 74.23 111.225 -172.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -60.12 -29.62 68.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.416 0.686 . . . . 74.23 111.609 -177.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -58.3 -48.46 80.44 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.684 1.194 . . . . 70.44 110.932 175.595 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.404 ' HB2' HG22 ' A' ' 50' ' ' ILE . 89.8 mt -79.05 -29.97 43.8 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 115.517 -0.765 . . . . 72.24 111.227 -177.576 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 93.5 mt -65.84 -43.48 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.874 0.869 . . . . 73.42 109.859 176.184 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.434 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 90.2 m-20 -69.96 -7.72 43.02 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.882 0.697 . . . . 62.52 112.882 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -91.89 -6.12 52.03 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 122.873 0.469 . . . . 73.54 110.946 174.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.482 ' HB3' HG12 ' A' ' 116' ' ' ILE . 19.3 p -140.2 104.78 4.89 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 123.748 0.819 . . . . 70.45 109.596 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.465 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 38.6 ttpt -56.69 -29.37 62.3 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.898 0.479 . . . . 74.11 111.461 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.512 ' HB2' ' NE2' ' A' ' 108' ' ' GLN . 25.5 tp -59.19 -46.62 87.95 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 123.292 0.637 . . . . 72.13 110.522 178.414 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.53 -47.16 86.61 Favored 'General case' 0 C--N 1.348 0.5 0 O-C-N 124.242 0.964 . . . . 73.24 110.375 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.434 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 97.6 mt-30 -54.4 -46.74 73.2 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.461 1.101 . . . . 75.55 111.57 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.465 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 15.0 mm100 -73.58 -35.26 65.42 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 116.043 -0.526 . . . . 74.32 112.027 -177.785 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 65.8 mt -65.45 -46.47 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 122.983 0.513 . . . . 74.42 110.319 177.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -70.08 -28.7 65.64 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.054 0.542 . . . . 75.24 111.71 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.5 tp -69.63 -55.99 8.52 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.727 0.411 . . . . 75.15 110.278 175.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -70.6 -26.81 63.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.367 -0.833 . . . . 63.21 110.949 -175.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.719 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 77.6 m -144.25 91.91 6.29 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 123.334 0.654 . . . . 54.44 109.932 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.58 3.01 5.18 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 122.97 2.447 . . . . 53.0 113.691 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -94.26 22.49 36.58 Favored Glycine 0 C--N 1.347 1.16 0 C-N-CA 122.82 0.248 . . . . 73.42 113.244 175.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 60.5 t -98.75 132.24 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.494 0.718 . . . . 72.53 109.707 172.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -88.61 -48.17 7.75 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.124 0.969 . . . . 73.13 112.602 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 53.9 p -159.25 163.24 36.02 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.859 0.464 . . . . 73.32 111.509 -177.158 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.416 ' O ' ' HA ' ' A' ' 49' ' ' VAL . 42.3 mt -124.88 125.59 44.21 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 107.983 -1.117 . . . . 63.12 107.983 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.488 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.9 ttm -105.47 112.68 25.86 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 107.657 -1.238 . . . . 70.3 107.657 174.826 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.461 HD13 HG21 ' A' ' 115' ' ' VAL . 18.9 mm -86.71 113.5 24.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.548 0 N-CA-C 107.956 -1.127 . . . . 74.44 107.956 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -84.12 -171.45 47.9 Favored Glycine 0 C--O 1.243 0.663 0 N-CA-C 111.373 -0.691 . . . . 65.14 111.373 174.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -70.12 -60.57 2.21 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.381 -0.599 . . . . 74.43 109.381 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -96.67 -37.09 10.47 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.587 1.155 . . . . 74.33 109.989 178.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -102.92 175.87 5.34 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.512 -1.222 . . . . 75.11 112.529 -165.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.407 HD22 HD12 ' A' ' 86' ' ' ILE . 29.2 tp -129.57 146.6 51.37 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 106.69 -1.596 . . . . 74.43 106.69 173.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.488 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 89.9 m -130.01 110.1 11.38 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.476 -0.935 . . . . 61.13 108.476 174.399 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.526 HG13 HD11 ' A' ' 101' ' ' ILE . 22.5 mm -88.56 118.18 33.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 108.653 -0.869 . . . . 72.35 108.653 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -96.28 116.92 29.79 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 107.9 -1.148 . . . . 74.51 107.9 172.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.436 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 19.5 pttp -104.58 175.02 5.63 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.527 0.731 . . . . 71.54 109.354 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -74.74 137.52 42.09 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.154 -0.93 . . . . 75.3 108.732 168.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -36.38 74.53 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.21 1.404 . . . . 74.34 113.002 -176.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 66.3 mtt -83.83 -15.17 49.28 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.565 0.746 . . . . 71.55 111.431 -177.713 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.9 t -88.33 144.76 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 109.323 -0.621 . . . . 74.22 109.323 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -105.11 144.56 31.74 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.101 0.961 . . . . 74.14 110.556 -171.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 53.1 m95 -66.98 -23.79 65.98 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 114.069 1.137 . . . . 73.11 114.069 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -61.48 -21.34 64.1 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.123 0.569 . . . . 75.34 112.0 -172.642 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -92.88 -33.78 14.08 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.393 0.677 . . . . 71.11 111.71 174.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.719 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 34.6 mt -83.44 -47.29 18.21 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 C-N-CA 123.245 0.618 . . . . 74.31 111.315 -166.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -53.83 -53.23 60.13 Favored Pre-proline 0 N--CA 1.486 1.355 0 CA-C-O 117.651 -1.166 . . . . 75.13 114.015 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -56.87 -37.93 97.07 Favored 'Trans proline' 0 C--N 1.399 3.231 0 C-N-CA 122.142 1.895 . . . . 73.15 111.701 -176.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -61.45 -53.78 52.09 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.033 -0.985 . . . . 73.33 110.396 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.526 HD11 HG13 ' A' ' 86' ' ' ILE . 65.0 mt -61.42 -51.94 67.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.904 0 O-C-N 124.132 0.895 . . . . 75.21 111.917 -178.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 98.0 mt -56.45 -43.61 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 123.757 0.823 . . . . 74.22 111.483 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.25 -48.99 79.57 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.906 0.754 . . . . 64.12 110.067 177.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.3 mt -58.39 -44.54 88.97 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 114.656 -1.157 . . . . 73.11 112.087 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.5 HD12 HD11 ' A' ' 63' ' ' LEU . 10.2 mp -65.84 -33.66 76.35 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.571 0.748 . . . . 74.33 111.755 -178.188 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 60.9 m -75.84 -34.68 60.08 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.219 0.608 . . . . 71.22 110.383 -176.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -75.19 -48.55 23.02 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.077 0.551 . . . . 73.44 110.177 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.512 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 23.6 tt0 -51.18 -59.9 3.69 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 125.586 1.554 . . . . 75.35 112.483 -176.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.4 mt -63.41 -26.88 68.94 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.761 -1.108 . . . . 74.32 110.97 -177.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.98 -10.12 59.35 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.917 0.887 . . . . 74.52 112.268 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -81.46 -15.18 55.81 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 122.61 0.364 . . . . 72.21 110.764 169.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 113.88 -28.7 8.27 Favored Glycine 0 C--N 1.346 1.119 0 CA-C-N 116.135 -0.484 . . . . 71.34 112.101 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -90.42 178.67 6.06 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.621 0.769 . . . . 73.53 112.724 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.542 ' HB3' ' O ' ' A' ' 40' ' ' LEU . 6.2 m-20 -110.23 -170.64 1.68 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.424 -1.262 . . . . 54.33 111.453 -170.237 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.464 ' HA ' ' NE2' ' A' ' 108' ' ' GLN . 7.2 p -57.97 -44.53 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.316 1.047 . . . . 71.21 112.196 178.401 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.482 HG12 ' HB3' ' A' ' 61' ' ' SER . 35.3 mt -133.13 152.45 35.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.68 1.192 . . . . 75.42 108.1 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 18.8 m -66.96 89.74 0.17 Allowed 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 109.195 -0.669 . . . . 75.52 109.195 171.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.413 ' H ' ' HD3' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -68.86 93.31 0.54 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.077 0.951 . . . . 73.22 110.718 -178.533 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 . . . . . 0 C--O 1.251 1.138 0 N-CA-C 108.728 -0.841 . . . . 72.42 108.728 -178.959 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.3 mtm . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 110.355 -0.239 . . . . 72.24 110.355 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 128.0 -84.67 0.33 Allowed Glycine 0 C--N 1.348 1.208 0 N-CA-C 111.196 -0.762 . . . . 73.33 111.196 176.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.6 t60 -141.94 135.25 29.21 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.892 0.877 . . . . 70.44 109.119 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -74.32 -78.21 0.1 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 123.298 0.639 . . . . 74.21 112.082 -176.172 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 29.4 m170 -141.0 171.84 13.5 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.839 0.856 . . . . 72.13 111.091 -172.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -93.98 142.07 27.8 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.75 0.82 . . . . 61.23 110.745 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -71.97 135.13 46.33 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.612 0.765 . . . . 73.34 110.388 177.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 -93.0 101.14 13.48 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.482 0.713 . . . . 74.53 109.082 176.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 41.6 m -91.58 117.78 30.03 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.123 0.569 . . . . 62.34 109.77 178.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.2 p80 -149.5 136.58 19.75 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.662 0.785 . . . . 75.0 109.786 -174.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.7 ttt -147.12 124.28 11.47 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.702 0.801 . . . . 71.12 109.739 -178.346 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -137.32 142.13 41.86 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.05 0.94 . . . . 75.41 108.472 175.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 57.2 m -145.32 133.24 21.27 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.294 0.638 . . . . 65.12 109.815 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.423 HE21 HD23 ' A' ' 16' ' ' LEU . 57.4 tp60 -147.46 116.85 6.98 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 123.966 0.906 . . . . 75.31 108.655 178.509 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -131.17 132.5 44.78 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.682 0.793 . . . . 75.3 109.044 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.423 HD23 HE21 ' A' ' 14' ' ' GLN . 2.6 pt? -157.1 156.18 32.33 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.158 0.583 . . . . 70.25 109.936 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.3 mm -69.31 107.77 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 109.161 -0.681 . . . . 75.12 109.161 175.193 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 59.2 m80 -74.04 116.01 14.18 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.484 1.114 . . . . 60.32 110.196 -177.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.8 mm -122.98 114.46 42.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.827 0 N-CA-C 107.697 -1.223 . . . . 65.02 107.697 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 40.7 ttmt -98.94 131.35 45.07 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.473 0.709 . . . . 73.51 109.992 -177.2 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.7 m -93.55 114.01 26.26 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.969 -0.752 . . . . 74.45 108.969 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.3 mt -121.14 137.61 54.59 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.859 0.864 . . . . 72.4 110.141 -175.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.2 p -85.73 153.83 22.05 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.876 0.87 . . . . 71.3 111.09 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.406 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 47.7 p -121.51 175.67 2.35 Favored Pre-proline 0 CA--C 1.56 1.35 0 N-CA-C 107.715 -1.217 . . . . 75.21 107.715 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . 0.406 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 62.6 Cg_endo -71.76 2.76 4.36 Favored 'Trans proline' 0 C--N 1.377 2.057 0 C-N-CA 121.886 1.724 . . . . 72.54 113.061 167.42 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.511 ' HB2' ' HB1' ' A' ' 29' ' ' ALA . 91.2 m-20 -108.3 135.7 49.17 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.212 1.005 . . . . 75.11 111.501 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -72.02 -25.37 61.79 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.207 1.003 . . . . 75.31 111.623 174.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.445 ' O ' ' HA ' ' A' ' 87' ' ' ASN . 86.7 m-20 -112.02 29.94 7.46 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.021 0.928 . . . . 71.22 110.553 -176.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.511 ' HB1' ' HB2' ' A' ' 26' ' ' ASN . . . -142.01 124.73 15.95 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.177 0.591 . . . . 74.12 109.634 172.341 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.1 tp -135.02 121.43 20.42 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 108.609 -0.885 . . . . 74.52 108.609 178.488 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.504 ' HE2' HD11 ' A' ' 33' ' ' LEU . 87.8 tttt -87.61 119.43 27.91 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.181 0.992 . . . . 72.33 111.116 -175.155 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -103.8 111.21 23.63 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 107.818 -1.178 . . . . 73.32 107.818 173.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.504 HD11 ' HE2' ' A' ' 31' ' ' LYS . 37.8 tp -104.35 128.16 52.13 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 124.382 1.073 . . . . 74.12 110.185 -167.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 28.4 m -70.76 105.69 3.29 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.753 -1.202 . . . . 73.4 107.753 170.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.0 m -86.87 -15.53 38.78 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.858 0.463 . . . . 72.14 111.754 -168.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.58 -64.3 1.1 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.531 0.733 . . . . 75.33 111.201 -178.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 39' ' ' MET . . . 156.08 -7.4 0.25 Allowed Glycine 0 C--N 1.341 0.847 0 CA-C-O 119.392 -0.671 . . . . 74.33 113.302 -174.281 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.472 ' HB3' ' HB3' ' A' ' 109' ' ' LEU . 1.0 OUTLIER -71.07 104.72 3.11 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 108.158 -1.053 . . . . 73.31 108.158 168.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.581 ' HE1' ' HB3' ' A' ' 82' ' ' ASP . 87.9 mtp -103.3 151.04 23.17 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.652 0.781 . . . . 74.42 110.605 -170.277 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.7 mt -71.4 -36.4 71.37 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.885 0.874 . . . . 63.23 112.008 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -129.64 -156.06 0.73 Allowed 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.515 0.726 . . . . 75.12 109.644 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.2 p -67.32 -146.76 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 124.052 0.941 . . . . 72.31 110.546 170.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -114.97 141.43 47.99 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 121.005 -1.06 . . . . 74.1 109.854 173.514 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 63.39 46.92 91.59 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 123.907 0.754 . . . . 64.33 112.5 -176.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 41.4 t -73.85 151.4 40.51 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.347 0.659 . . . . 72.4 111.0 -176.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -70.35 158.25 36.28 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 115.16 -0.927 . . . . 74.33 110.52 173.763 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.3 m -78.67 89.15 4.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.372 0.669 . . . . 74.04 109.431 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.61 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 42.8 mt -77.21 100.42 2.71 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 108.852 -0.795 . . . . 75.24 108.852 -177.358 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.1 t -90.33 109.8 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.549 0.74 . . . . 74.23 109.267 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 81.4 mt -118.73 111.06 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.39 1.076 . . . . 75.34 108.575 -178.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.495 ' HG2' ' HB3' ' A' ' 76' ' ' SER . 94.9 mttt -88.03 159.36 18.3 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 109.666 -0.494 . . . . 74.24 109.666 176.924 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -64.83 -20.93 66.66 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.918 0.487 . . . . 73.53 110.934 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 22.9 p -78.61 -31.23 46.96 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.124 0.97 . . . . 70.2 110.985 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -76.48 74.31 3.22 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.584 0.754 . . . . 74.45 110.128 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -55.88 -43.53 77.26 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.926 0.89 . . . . 65.31 111.742 -175.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -55.59 -48.31 75.05 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.09 0.956 . . . . 75.15 110.907 -177.484 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.3 mt -62.39 -36.05 81.09 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.102 -0.954 . . . . 72.2 111.052 -178.437 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 54.0 mt -73.51 -45.27 52.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 123.183 0.593 . . . . 71.3 110.311 -177.855 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -54.12 -30.87 50.49 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.422 1.089 . . . . 73.5 111.791 -178.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 64.1 m80 -87.81 -44.66 10.95 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.666 0.787 . . . . 71.13 110.703 175.833 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.638 ' HA ' ' HA ' ' A' ' 116' ' ' ILE . 50.5 m -79.04 98.76 6.6 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.056 0.455 . . . . 73.4 111.376 -176.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.499 ' HB2' ' HD2' ' A' ' 118' ' ' LYS . 31.6 ttpt -46.55 -53.08 12.07 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.716 1.607 . . . . 73.42 113.63 178.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.443 ' HB3' HG21 ' A' ' 115' ' ' VAL . 30.5 tp -65.3 -34.85 79.31 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.976 0.51 . . . . 75.35 111.722 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.15 -40.95 97.7 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 122.329 0.252 . . . . 75.01 110.527 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -56.07 -50.34 71.27 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.013 0.821 . . . . 75.42 110.305 176.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -60.83 -48.81 80.09 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.059 0.943 . . . . 74.01 113.127 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.3 -51.16 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 C-N-CA 123.403 0.681 . . . . 74.03 111.293 -175.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -67.23 -33.63 75.75 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.046 0.538 . . . . 75.23 111.193 -179.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.6 tp -59.81 -53.69 54.93 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.499 0.72 . . . . 74.04 110.794 176.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.493 ' NE2' HD21 ' A' ' 104' ' ' LEU . 74.1 mt-30 -77.45 -24.55 50.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 114.978 -1.01 . . . . 74.32 112.498 -175.044 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.55 ' SG ' HG21 ' A' ' 97' ' ' ILE . 72.7 m -144.84 96.91 4.99 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 109.35 -0.611 . . . . 72.11 109.35 -178.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.4 0.27 10.08 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 122.827 2.352 . . . . 73.12 113.132 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -84.68 -0.54 89.22 Favored Glycine 0 C--N 1.353 1.503 0 CA-C-O 119.89 -0.394 . . . . 74.23 113.023 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.0 t -82.22 123.76 38.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.237 0.615 . . . . 71.31 109.599 176.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -77.79 -55.0 5.69 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.932 0.893 . . . . 75.41 110.601 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.495 ' HB3' ' HG2' ' A' ' 51' ' ' LYS . 27.7 p -150.14 164.03 36.67 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.577 0.703 . . . . 74.41 111.459 -175.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 78.6 mt -122.57 128.66 51.02 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.427 1.091 . . . . 75.11 108.265 178.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.514 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.4 ttm -102.25 99.12 9.19 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 106.741 -1.577 . . . . 75.41 106.741 169.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.61 ' HB ' ' HB ' ' A' ' 48' ' ' ILE . 29.1 mm -80.87 125.22 39.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.24 -1.022 . . . . 75.53 108.24 -177.836 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.52 -173.18 20.8 Favored Glycine 0 C--O 1.242 0.6 0 N-CA-C 111.539 -0.625 . . . . 74.41 111.539 172.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -80.06 -58.18 3.28 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 122.807 0.443 . . . . 71.24 110.453 176.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.581 ' HB3' ' HE1' ' A' ' 39' ' ' MET . 8.4 p-10 -113.79 18.51 17.35 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 122.877 0.471 . . . . 71.41 110.92 179.615 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -148.5 163.61 36.66 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 122.755 0.422 . . . . 73.53 110.944 -177.232 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 51.8 tp -144.94 107.05 4.32 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.472 0.709 . . . . 74.22 109.243 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.514 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 28.0 m -96.95 106.74 19.13 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.299 -1.0 . . . . 75.13 108.299 -179.097 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.568 HG13 HD12 ' A' ' 101' ' ' ILE . 21.8 mm -87.47 141.53 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.518 0.727 . . . . 75.02 109.291 -175.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.445 ' HA ' ' O ' ' A' ' 28' ' ' ASN . 24.2 m-80 -120.82 120.63 36.13 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.802 0.841 . . . . 74.51 109.06 176.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.01 165.94 15.25 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.719 0.808 . . . . 75.42 110.191 179.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -68.0 141.45 56.24 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.696 0.798 . . . . 62.3 109.382 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.2 ptm180 -68.63 -10.98 59.43 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 112.855 0.687 . . . . 75.52 112.855 -171.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.3 ptp -77.95 -16.13 58.42 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.011 0.525 . . . . 75.31 111.133 174.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.522 HG11 HD11 ' A' ' 97' ' ' ILE . 34.4 t -93.54 141.98 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.148 0.979 . . . . 75.25 110.262 -176.697 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . 0.479 ' HD2' ' H ' ' A' ' 95' ' ' ASN . 4.8 t60 -95.17 136.23 35.77 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.922 0.889 . . . . 70.32 108.881 176.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 44.9 m95 -58.66 -43.55 89.89 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.611 0.967 . . . . 74.51 113.611 -174.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . 0.479 ' H ' ' HD2' ' A' ' 93' ' ' HIS . 9.8 t30 -57.82 -18.58 22.96 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.469 0.707 . . . . 70.22 112.717 -174.678 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.4 m -69.21 -54.27 15.63 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 121.386 0.613 . . . . 73.1 110.628 174.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.55 HG21 ' SG ' ' A' ' 71' ' ' CYS . 16.4 mt -83.96 -32.97 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 123.913 0.885 . . . . 75.3 110.858 -171.75 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -50.35 -56.08 20.95 Favored Pre-proline 0 CA--C 1.567 1.611 0 C-N-CA 125.038 1.335 . . . . 72.41 114.219 -172.134 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.58 -27.59 38.82 Favored 'Trans proline' 0 C--N 1.393 2.869 0 C-N-CA 121.8 1.666 . . . . 62.22 111.961 -176.305 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -67.78 -43.38 79.92 Favored 'General case' 0 C--N 1.349 0.568 0 C-N-CA 123.517 0.727 . . . . 75.23 109.746 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.568 HD12 HG13 ' A' ' 86' ' ' ILE . 95.6 mt -60.01 -51.16 76.15 Favored 'Isoleucine or valine' 0 C--N 1.359 0.998 0 C-N-CA 123.865 0.866 . . . . 72.13 109.784 176.807 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 74.0 mt -56.47 -41.04 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.522 0.729 . . . . 74.43 110.797 -178.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.75 -46.8 77.47 Favored 'General case' 0 CA--C 1.549 0.939 0 O-C-N 123.694 0.621 . . . . 55.11 110.933 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.493 HD21 ' NE2' ' A' ' 70' ' ' GLN . 99.0 mt -63.97 -35.07 79.48 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.958 0.903 . . . . 71.42 111.852 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -72.93 -23.72 60.72 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.83 0.852 . . . . 64.14 110.793 177.118 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 64.3 m -77.41 -36.59 53.17 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 109.183 -0.673 . . . . 75.02 109.183 174.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.53 ' HZ1' ' HE2' ' A' ' 111' ' ' TYR . 1.5 mmmp? -66.42 -39.29 88.88 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.341 0.656 . . . . 73.01 110.296 175.79 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.417 HE22 ' HE3' ' A' ' 62' ' ' LYS . 11.7 mm100 -60.19 -63.68 1.22 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.561 0.745 . . . . 73.45 110.714 176.787 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.472 ' HB3' ' HB3' ' A' ' 38' ' ' GLU . 74.2 mt -78.55 -2.83 40.7 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 114.854 -1.066 . . . . 74.23 112.377 -167.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -89.71 -49.03 6.88 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.531 0.732 . . . . 73.35 111.266 171.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.53 ' HE2' ' HZ1' ' A' ' 107' ' ' LYS . 14.5 m-85 -88.88 -52.35 5.15 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 116.129 -0.487 . . . . 72.14 110.78 -171.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -158.67 103.57 0.23 Allowed Glycine 0 C--N 1.342 0.884 0 N-CA-C 109.867 -1.293 . . . . 62.13 109.867 -175.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.99 -24.95 64.87 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.908 1.283 . . . . 72.51 112.778 -164.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -68.05 118.28 11.01 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 123.688 0.618 . . . . 73.34 109.96 -176.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.688 HG12 HG13 ' A' ' 116' ' ' ILE . 3.5 p -55.85 -42.71 71.68 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 125.625 1.57 . . . . 75.41 112.74 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.688 HG13 HG12 ' A' ' 115' ' ' VAL . 67.5 mt -92.94 -59.54 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.528 0.731 . . . . 72.51 109.839 -173.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.0 m -76.43 142.94 40.89 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 121.72 0.771 . . . . 73.33 112.543 -171.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.499 ' HD2' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -142.3 37.18 1.53 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.443 1.497 . . . . 72.21 107.961 176.124 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 . . . . . 0 CA--C 1.555 1.155 0 CA-C-N 114.202 -1.363 . . . . 75.34 109.872 -177.677 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.456 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.2 mpt? . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 108.748 -0.834 . . . . 73.24 108.748 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.62 142.04 39.7 Favored Glycine 0 C--N 1.35 1.322 0 O-C-N 123.858 0.723 . . . . 54.34 113.719 -176.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -125.96 134.89 51.38 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.874 0.87 . . . . 75.33 109.5 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -150.08 145.68 26.5 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.081 0.953 . . . . 73.33 109.374 178.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -132.12 152.9 50.98 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.455 0.702 . . . . 73.41 109.243 -177.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -84.98 126.63 33.69 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 110.158 -0.312 . . . . 71.03 110.158 176.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -75.36 123.89 26.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.71 0.804 . . . . 73.32 109.923 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -88.88 118.09 28.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.98 0.912 . . . . 73.15 109.88 176.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 43.0 m -94.78 156.81 16.22 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.481 0.712 . . . . 72.12 110.272 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.7 t-80 -66.18 97.7 0.4 Allowed 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.173 -0.677 . . . . 75.04 109.173 173.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 88.2 mtp -80.71 99.8 8.39 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 108.574 -0.899 . . . . 73.52 108.574 177.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -77.53 145.91 36.67 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.423 0.689 . . . . 73.34 111.229 -171.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.9 t -99.61 90.94 4.66 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 107.859 -1.163 . . . . 75.33 107.859 174.684 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -65.59 91.99 0.14 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.282 0.563 . . . . 74.14 110.322 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -133.21 70.71 1.46 Allowed 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.204 1.002 . . . . 74.5 108.798 177.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -151.15 149.04 29.0 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 123.806 0.842 . . . . 53.32 109.099 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.421 ' HB ' HG23 ' A' ' 106' ' ' THR . 77.0 mt -83.24 96.1 3.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.067 -1.086 . . . . 73.25 108.067 173.95 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.463 ' HB3' ' HB3' ' A' ' 36' ' ' ASP . 62.7 t60 -69.23 122.14 18.23 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 113.829 -1.532 . . . . 73.41 111.707 -170.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 47.9 mm -126.34 125.55 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 107.239 -1.393 . . . . 71.22 107.239 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -99.13 126.13 44.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.069 0.548 . . . . 74.23 109.541 -178.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 35.0 m -92.0 117.21 29.6 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.276 0.63 . . . . 73.43 109.382 -177.092 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.6 mt -115.11 138.47 50.86 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.179 0.991 . . . . 75.34 109.407 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 54.9 p -85.13 153.27 22.79 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.297 0.639 . . . . 73.12 110.568 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.7 p -119.52 172.73 4.14 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 124.291 1.037 . . . . 75.34 109.064 -174.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -75.17 14.86 0.83 Allowed 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 122.185 1.923 . . . . 74.15 113.215 167.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.4 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 11.1 m120 -118.95 157.16 28.26 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 124.167 0.987 . . . . 71.44 109.361 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.76 -32.93 10.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.276 0.631 . . . . 73.35 109.931 175.096 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -71.6 -40.63 69.71 Favored 'General case' 0 C--O 1.215 -0.759 0 C-N-CA 123.0 0.52 . . . . 74.52 110.153 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.4 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -93.09 141.22 28.66 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.075 0.55 . . . . 62.35 111.487 -175.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.8 tp -140.49 133.2 28.9 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 108.455 -0.943 . . . . 73.0 108.455 172.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -93.25 131.52 38.29 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.824 0.85 . . . . 73.34 110.672 -173.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -120.17 121.02 37.84 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.826 1.25 . . . . 75.11 107.996 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.3 tp -106.77 128.8 54.54 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.567 0.747 . . . . 73.51 110.488 -171.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.2 m -73.91 106.09 5.46 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.319 -0.993 . . . . 73.11 108.319 171.134 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.4 m -105.85 -32.19 8.48 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.024 0.53 . . . . 71.42 111.797 -163.61 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.463 ' HB3' ' HB3' ' A' ' 18' ' ' HIS . 5.8 p-10 -82.55 -162.55 0.59 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.273 0.229 . . . . 53.11 110.593 178.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.69 -16.67 63.8 Favored Glycine 0 C--N 1.355 1.589 0 N-CA-C 114.323 0.489 . . . . 54.51 114.323 -177.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -86.21 147.31 26.17 Favored 'General case' 0 C--N 1.352 0.688 0 CA-C-N 117.82 0.81 . . . . 73.01 110.266 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.491 ' HE3' ' HB3' ' A' ' 82' ' ' ASP . 25.4 ttt -147.05 130.64 16.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 107.638 -1.245 . . . . 70.53 107.638 -173.057 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 114' ' ' ASP . 64.1 mt -54.15 -45.94 72.14 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.87 0.868 . . . . 73.14 112.176 -171.126 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.549 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 5.4 tt0 -145.37 152.68 40.25 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.117 1.367 . . . . 73.12 108.757 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.2 m -73.96 150.08 40.97 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 123.437 0.695 . . . . 75.35 109.772 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.4 mmm180 -57.5 97.02 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.825 0.85 . . . . 75.22 109.719 174.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -154.48 -47.94 0.01 OUTLIER Glycine 0 N--CA 1.466 0.698 0 CA-C-N 115.868 -0.606 . . . . 64.12 111.773 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 29.2 t -110.4 177.41 4.7 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.345 0.658 . . . . 71.04 110.839 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -97.36 -174.37 2.91 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.845 1.258 . . . . 74.44 110.925 -174.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 28.0 p -76.82 88.02 3.42 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.235 0.614 . . . . 73.14 110.1 175.189 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.578 HD12 HD12 ' A' ' 116' ' ' ILE . 54.7 mt -76.8 127.61 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.803 0.841 . . . . 74.25 110.828 -177.189 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 95.6 t -89.79 123.81 42.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 N-CA-C 109.127 -0.694 . . . . 74.25 109.127 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.447 HG12 ' HB3' ' A' ' 57' ' ' LEU . 54.5 mt -116.02 110.11 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 108.283 -1.006 . . . . 73.15 108.283 174.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -90.87 164.79 13.92 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 109.203 -0.666 . . . . 75.41 109.203 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -57.44 -27.35 62.36 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 124.168 0.918 . . . . 74.04 112.292 175.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.5 p -75.31 -33.76 61.2 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.64 0.776 . . . . 73.51 111.86 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.417 ' O ' HG13 ' A' ' 58' ' ' ILE . 3.9 m-20 -78.86 74.23 5.39 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.431 0.692 . . . . 72.11 111.164 -170.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -50.49 -42.38 54.6 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.977 1.311 . . . . 73.04 111.565 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -58.37 -49.25 77.91 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.752 0.821 . . . . 75.23 111.476 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.447 ' HB3' HG12 ' A' ' 50' ' ' ILE . 80.4 mt -70.49 -38.82 74.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.538 0.735 . . . . 63.45 111.362 -175.596 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 54' ' ' ASP . 81.4 mt -57.76 -48.13 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.02 0.928 . . . . 75.44 109.443 175.078 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.402 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 89.5 m-20 -66.64 -26.05 66.88 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.355 0.872 . . . . 62.31 113.355 -179.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -70.52 -36.57 73.83 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.536 0.334 . . . . 74.42 111.383 178.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.426 ' HB3' HG21 ' A' ' 116' ' ' ILE . 38.5 p -116.62 105.72 12.75 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.518 0.727 . . . . 72.42 109.552 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -62.77 -19.94 64.48 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.993 0.517 . . . . 74.02 111.427 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.552 HD13 HD12 ' A' ' 105' ' ' LEU . 48.7 tp -60.04 -46.98 87.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.366 0.666 . . . . 72.24 110.1 170.466 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.13 -41.81 99.38 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.242 0.617 . . . . 64.23 110.745 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.402 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 99.4 mt-30 -56.4 -48.6 76.59 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 123.861 0.726 . . . . 74.32 110.883 175.667 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -60.51 -44.56 95.88 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.86 0.864 . . . . 63.32 112.79 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.49 HG22 HG23 ' A' ' 74' ' ' VAL . 97.1 mt -66.54 -46.41 86.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 123.35 0.66 . . . . 75.1 110.605 -177.215 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -68.95 -37.07 78.63 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.799 0.44 . . . . 75.34 111.779 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.2 tp -66.82 -53.83 28.73 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.526 0.73 . . . . 73.3 110.604 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -81.0 -24.05 38.25 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 114.941 -1.027 . . . . 72.31 111.666 -173.231 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 38.2 m -126.37 97.15 34.72 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 109.487 -0.56 . . . . 75.03 109.487 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.11 -17.34 45.59 Favored 'Trans proline' 0 C--N 1.378 2.093 0 C-N-CA 123.59 2.86 . . . . 64.25 113.879 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -89.96 13.59 64.21 Favored Glycine 0 C--N 1.346 1.11 0 CA-C-O 119.69 -0.505 . . . . 73.01 113.576 -177.246 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.49 HG23 HG22 ' A' ' 67' ' ' ILE . 41.6 t -85.69 122.4 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.732 -0.84 . . . . 72.02 108.732 173.623 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -90.06 -40.49 12.26 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.509 0.724 . . . . 74.03 110.085 -177.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.9 p -160.1 170.85 20.38 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.486 -0.779 . . . . 72.4 110.832 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 85.4 mt -131.61 150.52 52.12 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.045 1.338 . . . . 72.04 108.516 177.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.416 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 57.6 ttm -123.85 102.56 7.86 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 107.255 -1.387 . . . . 75.22 107.255 167.993 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 15.3 mm -82.5 120.45 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 115.552 -0.749 . . . . 73.54 109.176 -177.611 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.06 -179.7 21.28 Favored Glycine 0 C--O 1.242 0.642 0 N-CA-C 111.41 -0.676 . . . . 73.01 111.41 172.558 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.549 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 4.5 p-10 -72.33 -53.8 11.32 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.294 0.638 . . . . 74.5 110.774 178.363 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.491 ' HB3' ' HE3' ' A' ' 39' ' ' MET . 14.0 p-10 -116.58 -0.3 12.47 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.755 -0.591 . . . . 73.55 111.435 177.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -126.52 156.24 41.09 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.754 -0.462 . . . . 75.22 109.754 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.527 HD21 HD13 ' A' ' 105' ' ' LEU . 39.5 tp -144.84 119.69 9.92 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.216 -0.661 . . . . 74.32 109.216 176.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.416 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 32.9 m -107.59 108.35 19.59 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 109.415 -0.587 . . . . 75.3 109.415 -177.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.502 ' HB ' ' HH2' ' A' ' 94' ' ' TRP . 21.1 mm -89.66 141.48 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 N-CA-C 108.259 -1.015 . . . . 74.34 108.259 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -114.31 119.67 37.76 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.601 -0.518 . . . . 75.01 109.601 179.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.556 ' HZ2' HD13 ' A' ' 97' ' ' ILE . 5.0 mptp? -105.45 159.31 16.03 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.684 1.194 . . . . 72.52 110.734 177.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -69.49 145.46 52.69 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 114.187 -1.369 . . . . 73.41 109.254 172.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -25.69 68.42 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 123.886 0.874 . . . . 75.2 113.093 -176.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 65.6 mtm -87.58 -9.01 55.55 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.672 0.789 . . . . 74.54 111.276 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 39.8 t -102.53 135.98 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 109.528 -0.545 . . . . 71.44 109.528 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -79.64 138.17 37.32 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.233 1.013 . . . . 61.01 111.387 -172.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.502 ' HH2' ' HB ' ' A' ' 86' ' ' ILE . 6.0 m95 -80.38 -52.8 7.25 Favored 'General case' 0 N--CA 1.483 1.217 0 N-CA-C 113.277 0.844 . . . . 73.22 113.277 -174.794 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.87 -18.16 54.52 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.782 0.833 . . . . 63.41 112.843 -174.664 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.1 t -74.67 -40.77 61.21 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.168 0.987 . . . . 73.43 110.267 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.556 HD13 ' HZ2' ' A' ' 88' ' ' LYS . 16.2 mt -94.12 -15.54 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 CA-C-N 115.162 -0.926 . . . . 74.11 112.552 -168.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -49.63 -47.89 77.64 Favored Pre-proline 0 N--CA 1.491 1.579 0 CA-C-O 118.193 -0.908 . . . . 72.25 113.114 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -56.36 -39.12 93.39 Favored 'Trans proline' 0 C--N 1.396 3.073 0 C-N-CA 122.012 1.808 . . . . 62.15 113.126 176.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.451 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 8.3 mm-40 -63.61 -50.95 67.36 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.344 0.658 . . . . 74.11 110.403 -178.674 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.418 ' O ' HD11 ' A' ' 105' ' ' LEU . 76.4 mt -61.17 -54.84 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.017 -0.992 . . . . 74.24 110.489 -177.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 89.1 mt -55.37 -38.28 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 123.511 0.724 . . . . 74.23 110.96 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -66.17 -43.69 86.19 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.493 0.717 . . . . 74.34 111.112 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.451 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 88.9 mt -64.35 -38.57 91.52 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.463 0.705 . . . . 74.23 111.194 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.552 HD12 HD13 ' A' ' 63' ' ' LEU . 10.0 mp -63.52 -34.45 77.81 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.645 0.778 . . . . 75.23 110.277 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.421 HG23 ' HB ' ' A' ' 17' ' ' ILE . 93.1 m -72.96 -31.32 64.48 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.302 0.641 . . . . 74.0 110.102 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -63.86 -54.42 35.22 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.9 0.48 . . . . 75.54 110.35 176.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -58.27 -45.05 88.58 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 123.824 0.703 . . . . 73.44 111.541 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 40' ' ' LEU . 95.8 mt -75.93 -17.83 59.6 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.091 -0.959 . . . . 74.51 111.434 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.34 -28.8 59.75 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.143 0.577 . . . . 63.22 110.418 172.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -72.31 -27.09 62.23 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.148 -0.478 . . . . 74.25 109.921 168.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.67 30.38 64.12 Favored Glycine 0 C--N 1.353 1.516 0 CA-C-N 115.513 -0.767 . . . . 65.33 111.213 -172.623 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -92.91 139.96 29.98 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.441 1.096 . . . . 74.34 111.151 -171.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.426 ' HA ' ' O ' ' A' ' 40' ' ' LEU . 5.8 m-20 -76.65 119.11 20.01 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.474 -0.936 . . . . 74.52 108.474 169.331 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 2.7 p -49.15 -50.03 15.74 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 C-N-CA 125.636 1.574 . . . . 71.23 112.385 -176.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.578 HD12 HD12 ' A' ' 48' ' ' ILE . 1.7 pp -160.03 162.67 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 125.854 1.662 . . . . 74.32 107.588 173.098 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 55.6 m -104.43 -87.69 0.44 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 107.019 -1.474 . . . . 64.11 107.019 165.042 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -122.73 -34.74 3.17 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.085 0.554 . . . . 72.35 111.246 -174.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 . . . . . 0 C--O 1.254 1.325 0 N-CA-C 109.191 -0.67 . . . . 72.25 109.191 -178.248 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.486 1.368 0 N-CA-C 109.737 -0.468 . . . . 62.43 109.737 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -115.04 23.82 11.22 Favored Glycine 0 C--N 1.351 1.377 0 CA-C-N 115.981 -0.554 . . . . 54.02 112.368 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -75.8 87.31 2.81 Favored 'General case' 0 C--N 1.353 0.718 0 N-CA-C 108.246 -1.02 . . . . 71.51 108.246 174.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 70.5 t60 -73.0 107.03 5.13 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.904 -0.776 . . . . 72.43 108.904 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -76.62 124.87 28.28 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 124.155 0.91 . . . . 73.45 110.664 -175.004 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 25.7 p-80 -142.25 70.08 1.33 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 122.112 0.958 . . . . 74.41 109.384 177.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 66.1 t60 -112.36 102.84 10.96 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 114.916 -1.038 . . . . 75.42 109.777 -177.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -158.79 44.14 0.27 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.713 0.805 . . . . 74.21 109.997 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.4 m -117.04 98.39 6.44 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 109.533 -0.543 . . . . 74.22 109.533 174.6 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -167.09 139.87 3.5 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.244 1.017 . . . . 74.35 109.281 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 55.7 tpp -134.41 95.26 3.35 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.467 -0.938 . . . . 71.43 108.467 174.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -73.99 -20.93 60.18 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.387 -0.824 . . . . 71.04 111.123 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.7 m -79.32 33.9 0.24 Allowed 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 124.377 1.071 . . . . 73.33 112.554 -177.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -93.91 27.77 2.65 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 121.679 -0.638 . . . . 74.34 111.724 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -82.48 173.96 11.52 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.814 0.846 . . . . 53.33 109.955 172.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -132.0 128.27 38.02 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 108.133 -1.062 . . . . 73.24 108.133 172.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.8 mt -78.22 117.51 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.111 0.564 . . . . 74.24 109.808 -176.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -72.31 122.24 20.81 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.421 -0.809 . . . . 74.2 109.564 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.8 mm -115.55 122.22 68.91 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 105.599 -2.0 . . . . 72.31 105.599 177.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -91.01 120.59 32.13 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.308 -0.997 . . . . 74.25 108.308 -172.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.7 m -93.25 113.29 25.46 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.522 -0.918 . . . . 63.52 108.522 -176.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.9 mt -105.83 138.14 42.53 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.601 0.76 . . . . 65.21 109.388 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.0 p -73.71 142.63 46.34 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.708 0.803 . . . . 71.42 110.695 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 p -113.09 168.0 8.4 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 124.681 1.192 . . . . 71.03 109.827 -174.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -67.73 -10.87 30.21 Favored 'Trans proline' 0 C--N 1.383 2.388 0 C-N-CA 122.693 2.262 . . . . 71.42 113.459 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -125.12 134.52 52.42 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.456 0.702 . . . . 71.44 109.761 -178.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -73.2 -24.85 60.57 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.279 0.632 . . . . 71.24 110.973 173.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -66.08 -20.75 66.26 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.115 0.966 . . . . 74.2 111.218 176.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.1 162.56 22.22 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.24 1.016 . . . . 74.41 110.107 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.4 tp -160.66 131.24 5.36 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 109.571 -0.529 . . . . 73.31 109.571 173.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -85.44 117.11 24.16 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.281 1.032 . . . . 74.21 110.85 -174.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -107.77 110.8 22.7 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.399 1.079 . . . . 73.44 108.216 173.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.6 tp -102.84 123.61 46.81 Favored 'General case' 0 C--O 1.243 0.744 0 N-CA-C 108.674 -0.861 . . . . 61.22 108.674 -169.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.1 p -80.87 106.21 12.7 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 107.828 -1.175 . . . . 75.2 107.828 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.2 p -109.89 -58.52 2.05 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.765 0.826 . . . . 74.43 110.181 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -69.72 110.29 4.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.135 0.974 . . . . 72.32 111.607 -172.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.08 -85.23 1.01 Allowed Glycine 0 C--N 1.342 0.911 0 O-C-N 124.107 0.879 . . . . 74.2 112.989 174.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.8 mp0 -95.62 164.14 12.9 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.9 0.88 . . . . 74.24 111.993 -170.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.3 ttt -125.58 147.28 49.34 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.077 1.751 . . . . 72.13 107.554 -177.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.7 mt -67.35 -51.97 45.84 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.085 0.772 . . . . 72.51 113.085 -169.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.622 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.1 tt0 -141.78 163.43 32.92 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.239 0.616 . . . . 72.51 109.55 -172.148 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.6 m -70.08 134.87 48.66 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.617 0.767 . . . . 74.41 110.256 174.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -71.24 155.36 40.8 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.989 0.516 . . . . 75.31 110.151 174.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 89.92 47.03 4.03 Favored Glycine 0 C--N 1.345 1.054 0 N-CA-C 109.829 -1.308 . . . . 75.31 109.829 -172.199 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.5 p -148.54 173.16 13.43 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.105 0.962 . . . . 73.41 110.04 -172.125 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -98.26 162.49 13.16 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.635 0.774 . . . . 75.14 110.067 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 p -82.82 99.5 9.74 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.615 0.766 . . . . 74.03 109.774 176.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.0 mt -76.87 107.73 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 123.142 0.577 . . . . 73.4 110.377 -173.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 76.8 t -87.55 105.34 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 108.046 -1.094 . . . . 74.24 108.046 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.492 HD12 ' HG ' ' A' ' 61' ' ' SER . 75.2 mt -94.83 109.09 21.73 Favored 'Isoleucine or valine' 0 C--N 1.337 0.062 0 N-CA-C 107.999 -1.112 . . . . 75.13 107.999 -178.325 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -87.64 142.22 28.01 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.679 0.792 . . . . 74.41 109.77 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.466 ' HA ' HD11 ' A' ' 58' ' ' ILE . 36.9 p30 -67.43 -22.45 65.51 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.245 0.618 . . . . 74.35 111.574 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.2 t -87.85 -4.79 58.83 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.95 0.9 . . . . 71.42 112.043 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -108.11 103.7 12.97 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.102 0.561 . . . . 62.34 110.186 -175.24 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -45.44 -61.97 1.46 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 124.932 1.293 . . . . 55.3 113.605 176.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -69.65 -30.95 68.76 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.758 0.651 . . . . 73.01 112.758 -166.062 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.17 -36.17 83.18 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 123.397 0.436 . . . . 73.32 111.666 175.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.466 HD11 ' HA ' ' A' ' 52' ' ' ASN . 39.6 mt -84.22 -38.17 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 123.309 0.644 . . . . 71.11 110.381 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -56.19 -39.85 73.06 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 125.061 1.344 . . . . 64.52 112.15 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -85.98 -1.98 57.85 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.798 -0.637 . . . . 74.23 111.566 -176.685 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.492 ' HG ' HD12 ' A' ' 50' ' ' ILE . 34.0 p -127.78 101.38 6.33 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.208 0.603 . . . . 73.22 111.135 -172.828 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -57.65 -47.28 82.72 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.473 1.109 . . . . 74.32 112.287 -177.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 49.5 tp -63.93 -35.99 82.47 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 123.912 0.758 . . . . 74.31 111.409 -178.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.39 -40.94 89.96 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.668 0.387 . . . . 72.11 111.189 178.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -58.79 -43.5 90.5 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 124.241 0.963 . . . . 74.05 110.242 176.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -58.66 -51.45 69.88 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.644 0.778 . . . . 75.14 112.519 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 83.3 mt -66.18 -44.54 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.434 0.694 . . . . 73.35 111.35 -173.563 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -71.13 -37.69 72.3 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 112.243 0.46 . . . . 74.51 112.243 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 42.9 tp -69.87 -45.92 66.65 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.865 0.466 . . . . 74.54 110.919 -177.466 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -81.08 -29.88 34.84 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.222 0.609 . . . . 74.53 111.691 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 63.9 m -133.28 88.11 36.5 Favored Pre-proline 0 CA--C 1.548 0.904 0 N-CA-C 109.057 -0.72 . . . . 74.14 109.057 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -77.02 -2.32 12.56 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 122.735 2.29 . . . . 75.44 112.758 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.04 3.4 71.13 Favored Glycine 0 C--N 1.356 1.659 0 CA-C-N 116.327 -0.397 . . . . 71.43 113.18 176.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.0 t -92.68 133.3 34.42 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.405 1.082 . . . . 74.41 109.974 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.43 ' H ' ' HA ' ' A' ' 88' ' ' LYS . 16.2 mm-40 -86.16 -49.95 7.36 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.381 1.072 . . . . 72.34 110.703 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.6 p -159.21 163.46 35.91 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.488 -0.778 . . . . 71.41 111.066 -175.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.4 mt -121.86 125.98 47.68 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 108.535 -0.913 . . . . 74.2 108.535 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.579 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.1 ttm -98.64 99.82 10.98 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 106.897 -1.519 . . . . 74.23 106.897 174.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.603 HD12 HD12 ' A' ' 84' ' ' LEU . 19.1 mm -85.41 110.67 19.78 Favored 'Isoleucine or valine' 0 C--O 1.242 0.662 0 N-CA-C 108.765 -0.828 . . . . 75.42 108.765 -172.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -101.25 173.68 24.38 Favored Glycine 0 C--O 1.247 0.931 0 N-CA-C 109.802 -1.319 . . . . 63.12 109.802 173.285 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.622 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 10.5 p-10 -74.93 -44.66 47.32 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 122.87 0.468 . . . . 64.33 110.022 175.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -86.81 -41.72 13.85 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.448 0.699 . . . . 70.23 111.468 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 36.4 p90 -131.2 171.62 13.08 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 121.247 0.546 . . . . 72.4 112.204 -164.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.603 HD12 HD12 ' A' ' 79' ' ' ILE . 14.1 tp -139.51 110.8 6.99 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.731 1.212 . . . . 64.53 107.915 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.579 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 66.7 m -95.42 108.18 20.37 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.088 -1.079 . . . . 74.51 108.088 -177.787 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.57 HG13 HD13 ' A' ' 101' ' ' ILE . 12.0 mm -87.01 102.9 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.501 0.72 . . . . 75.21 109.152 -173.456 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -84.2 128.08 34.34 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 107.33 -1.359 . . . . 73.2 107.33 175.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.43 ' HA ' ' H ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -148.93 168.1 23.98 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.603 0.761 . . . . 73.21 111.867 -171.28 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -71.42 122.79 21.01 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.197 1.399 . . . . 71.31 109.799 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -71.45 -12.5 61.43 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 113.147 0.795 . . . . 74.12 113.147 -170.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.7 mmm -78.06 -30.94 50.02 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.754 -0.461 . . . . 75.3 109.754 175.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.6 t -83.34 144.94 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 107.923 -1.14 . . . . 75.33 107.923 175.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -102.14 158.65 16.01 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.3 0.64 . . . . 72.4 111.636 -171.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -75.68 -24.73 56.31 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.977 0.911 . . . . 73.44 112.143 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -59.86 -27.32 66.58 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.423 0.689 . . . . 64.44 111.223 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.2 m -92.79 -35.55 13.35 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.954 0.902 . . . . 73.53 112.412 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 24.5 mt -93.28 -45.66 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 CA-C-N 117.861 0.301 . . . . 71.31 111.212 -170.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -53.5 -46.29 98.19 Favored Pre-proline 0 N--CA 1.492 1.674 0 N-CA-C 114.522 1.304 . . . . 72.4 114.522 -174.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -55.41 -39.59 90.2 Favored 'Trans proline' 0 C--N 1.392 2.866 0 C-N-CA 121.803 1.668 . . . . 71.04 112.168 175.37 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -68.22 -40.45 82.08 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.466 -0.788 . . . . 75.53 110.382 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.57 HD13 HG13 ' A' ' 86' ' ' ILE . 84.8 mt -62.48 -52.01 65.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.551 0.74 . . . . 73.12 110.364 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 79.4 mt -61.32 -37.54 77.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.369 0.668 . . . . 74.53 110.83 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.25 -47.69 72.92 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.431 0.692 . . . . 75.03 111.057 178.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 98.4 mt -68.44 -35.26 77.35 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.761 0.825 . . . . 75.11 111.99 -179.012 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.0 mp -69.34 -23.79 63.82 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.315 0.646 . . . . 73.01 110.492 175.084 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 53.8 m -78.9 -44.96 21.58 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.265 0.626 . . . . 72.23 109.993 173.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -57.46 -49.58 75.82 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.017 0.927 . . . . 73.33 110.483 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -50.57 -60.74 2.71 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.556 1.142 . . . . 74.52 111.366 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.4 mt -75.43 -19.11 59.68 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 115.682 -0.69 . . . . 74.54 112.058 -170.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.53 -46.72 14.07 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.599 0.76 . . . . 74.45 110.769 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -80.15 -15.02 57.99 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 115.92 -0.582 . . . . 73.13 111.208 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 84.45 19.27 60.63 Favored Glycine 0 C--N 1.35 1.316 0 CA-C-N 116.405 -0.361 . . . . 74.0 112.796 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.15 167.75 17.12 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.442 1.097 . . . . 73.33 111.148 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.36 139.4 34.18 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.323 1.049 . . . . 64.45 110.172 -174.548 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 4.1 p -66.88 -49.59 72.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 N-CA-C 108.868 -0.79 . . . . 70.11 108.868 165.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.557 HD13 HG13 ' A' ' 79' ' ' ILE . 71.0 mt -140.49 -59.67 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 106.224 -1.769 . . . . 70.25 106.224 177.38 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.2 p -157.23 134.91 10.72 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 113.747 -1.569 . . . . 75.31 108.189 171.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -87.67 41.2 0.97 Allowed 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.013 0.925 . . . . 74.41 109.875 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 . . . . . 0 C--O 1.253 1.268 0 N-CA-C 107.115 -1.439 . . . . 75.31 107.115 -172.637 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.2 mtp . . . . . 0 N--CA 1.482 1.17 0 N-CA-C 109.225 -0.657 . . . . 62.54 109.225 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 71.54 -145.76 39.35 Favored Glycine 0 C--N 1.35 1.317 0 O-C-N 123.68 0.613 . . . . 73.21 111.784 -176.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 64.77 5.66 2.92 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.577 1.151 . . . . 74.15 112.673 174.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 39.1 t-80 -77.97 112.78 15.22 Favored 'General case' 0 C--N 1.353 0.718 0 C-N-CA 122.881 0.472 . . . . 74.35 110.449 -173.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -127.53 -73.37 0.61 Allowed 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.516 -0.766 . . . . 74.54 109.159 174.562 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 49.23 44.8 23.44 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 121.625 0.726 . . . . 65.13 110.151 -168.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.2 t60 -64.31 95.64 0.14 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.139 -1.391 . . . . 62.33 110.607 -170.557 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -138.86 122.1 16.99 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.336 -0.847 . . . . 63.32 109.497 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -120.51 84.69 2.26 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.354 1.062 . . . . 74.2 108.248 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.9 t60 -158.67 129.29 6.1 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.858 0.863 . . . . 72.34 109.778 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -159.14 129.86 5.98 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 123.147 0.579 . . . . 75.53 110.111 172.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -124.38 87.7 2.77 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 107.985 -1.117 . . . . 74.43 107.985 171.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 41.6 m -137.05 76.37 1.58 Allowed 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.037 -0.983 . . . . 75.04 108.895 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -110.13 -53.48 2.67 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 114.924 -1.035 . . . . 72.34 110.042 -174.266 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -133.91 124.98 27.33 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.68 0.792 . . . . 75.23 110.245 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -148.35 119.19 7.58 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 108.238 -1.023 . . . . 74.14 108.238 169.856 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.0 mt -115.46 107.89 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 N-CA-C 109.136 -0.69 . . . . 75.32 109.136 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -64.15 118.54 8.72 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.848 1.259 . . . . 74.13 110.389 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 42.1 mm -122.37 113.42 38.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 N-CA-C 106.193 -1.78 . . . . 75.22 106.193 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -105.57 119.96 40.44 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 106.891 -1.522 . . . . 65.43 106.891 -175.449 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.483 HG22 ' HD2' ' A' ' 98' ' ' LYS . 12.3 t -109.58 111.81 23.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-O 121.834 0.826 . . . . 72.12 108.934 -171.458 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.0 mt -91.56 147.6 22.89 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.152 -0.931 . . . . 73.3 111.342 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.9 p -81.66 145.86 30.34 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.669 -1.15 . . . . 74.25 110.011 176.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 50.1 p -115.81 176.65 1.44 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 107.939 -1.134 . . . . 73.32 107.939 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -49.8 -30.35 22.89 Favored 'Trans proline' 0 C--N 1.384 2.41 0 C-N-CA 122.079 1.852 . . . . 74.33 113.4 165.548 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -86.19 146.26 26.63 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 109.083 -0.71 . . . . 73.34 109.083 174.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -88.76 -36.22 16.24 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.946 0.898 . . . . 71.23 110.838 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -91.49 -17.39 25.78 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.461 1.104 . . . . 74.05 111.982 -171.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -99.77 109.34 21.77 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.219 -1.03 . . . . 75.45 108.219 169.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.2 tp -114.96 126.77 55.16 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.696 -0.853 . . . . 73.34 108.696 -175.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -92.47 110.08 21.48 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.088 0.955 . . . . 75.34 110.294 -170.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -92.56 127.19 37.96 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.599 0.76 . . . . 74.23 109.642 -177.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.3 tp -117.65 137.94 52.31 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.565 0.746 . . . . 74.14 109.835 -179.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.0 t -89.99 121.27 31.93 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.314 -0.995 . . . . 65.12 108.314 170.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 34.3 p -99.6 0.62 42.53 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.455 0.539 . . . . 74.53 112.455 -176.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -103.53 33.11 3.49 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.022 0.529 . . . . 73.35 111.721 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.68 -44.99 3.29 Favored Glycine 0 C--N 1.347 1.151 0 CA-C-O 119.755 -0.47 . . . . 73.44 113.97 171.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.507 ' HB3' HD23 ' A' ' 109' ' ' LEU . 9.3 mm-40 -59.29 92.06 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.68 0.792 . . . . 73.42 112.764 -177.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.445 ' HE2' ' HB3' ' A' ' 82' ' ' ASP . 51.4 ttm -78.94 138.54 38.13 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 114.822 -1.081 . . . . 75.41 109.104 173.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.3 mt -63.86 -56.14 17.59 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.772 0.829 . . . . 72.34 111.279 -172.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -129.68 133.84 47.32 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.895 -1.15 . . . . 72.02 107.895 173.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.9 p -57.68 137.46 56.43 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.544 0.738 . . . . 75.55 111.605 -173.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -59.44 120.63 9.7 Favored 'General case' 0 CA--C 1.549 0.933 0 O-C-N 124.031 0.832 . . . . 75.2 111.544 -168.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 135.75 -6.86 4.17 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 114.864 -1.062 . . . . 73.25 111.017 -168.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.0 t -76.3 174.92 9.58 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.917 1.287 . . . . 65.44 111.27 178.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.79 158.13 20.49 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.585 1.154 . . . . 75.32 108.383 177.186 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.5 m -76.58 93.29 3.56 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.314 0.645 . . . . 74.45 110.038 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.434 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 56.1 mt -74.87 104.54 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.596 0.758 . . . . 72.23 110.246 -177.236 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.522 HG22 ' HE3' ' A' ' 78' ' ' MET . 46.4 t -81.29 108.69 14.79 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 123.443 0.697 . . . . 73.2 109.165 -178.106 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.48 HD12 HD13 ' A' ' 116' ' ' ILE . 53.3 mt -106.06 108.36 24.88 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 N-CA-C 107.348 -1.353 . . . . 74.05 107.348 175.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -94.71 166.01 12.21 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 108.725 -0.842 . . . . 73.52 108.725 175.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.444 ' HA ' HD12 ' A' ' 58' ' ' ILE . 30.7 p30 -70.9 -8.9 56.19 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 120.65 0.262 . . . . 74.3 111.548 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.3 p -85.56 -25.31 26.82 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.494 0.718 . . . . 73.31 110.928 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -86.39 70.68 10.51 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.254 0.622 . . . . 74.41 109.495 177.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -56.65 -37.45 70.79 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.529 -0.759 . . . . 71.12 111.025 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -53.08 -44.83 67.86 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.614 1.166 . . . . 75.42 111.734 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.6 mt -73.39 -30.39 63.24 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 116.084 -0.507 . . . . 74.02 111.659 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.444 HD12 ' HA ' ' A' ' 52' ' ' ASN . 77.6 mt -70.17 -43.47 78.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 123.648 0.779 . . . . 74.41 110.66 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -54.08 -39.52 66.4 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.647 0.779 . . . . 65.22 112.703 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -99.08 28.84 4.17 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 120.88 0.371 . . . . 75.24 111.907 -177.542 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.6 t -151.25 100.31 2.74 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 108.652 -0.869 . . . . 75.34 108.652 173.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -56.95 -38.34 72.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.769 0.828 . . . . 74.33 110.288 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.508 HD11 HD12 ' A' ' 105' ' ' LEU . 31.8 tp -59.91 -45.08 93.72 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 124.124 0.89 . . . . 74.41 110.492 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.61 -43.41 96.94 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.1 0.56 . . . . 70.21 111.645 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -56.29 -50.65 70.82 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 124.14 0.9 . . . . 72.41 110.758 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 18.1 mm100 -66.4 -39.03 88.77 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 124.299 1.0 . . . . 73.11 112.365 -177.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 77.8 mt -64.94 -50.61 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 122.561 0.344 . . . . 74.3 110.883 179.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -67.51 -31.43 71.54 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.696 0.398 . . . . 74.04 111.736 179.54 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.8 tp -69.98 -53.59 17.05 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.04 0.536 . . . . 74.35 110.734 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -71.95 -29.32 64.14 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.672 -0.694 . . . . 64.23 111.205 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.65 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 37.9 m -132.29 93.23 26.34 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 123.119 0.568 . . . . 63.23 110.009 -176.786 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.29 -10.43 22.41 Favored 'Trans proline' 0 C--N 1.37 1.689 0 C-N-CA 122.981 2.454 . . . . 62.42 113.357 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -82.18 -3.05 90.69 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-O 119.988 -0.34 . . . . 74.3 113.407 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 91.7 t -77.18 121.73 30.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 C-N-CA 123.542 0.737 . . . . 75.01 109.66 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -74.47 -48.78 25.3 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.854 0.862 . . . . 74.43 109.706 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.8 t -162.5 154.81 19.02 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.401 -1.272 . . . . 61.11 110.717 -170.294 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 36.2 mt -108.35 158.11 17.79 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.096 1.359 . . . . 75.13 108.745 169.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.522 ' HE3' HG22 ' A' ' 49' ' ' VAL . 52.0 ttm -137.49 113.92 10.21 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.246 -1.02 . . . . 75.35 108.246 170.439 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.591 HD12 HD11 ' A' ' 84' ' ' LEU . 22.0 mm -88.91 118.55 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 N-CA-C 107.958 -1.127 . . . . 74.0 107.958 -175.979 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -108.51 -164.21 20.86 Favored Glycine 0 C--O 1.242 0.652 0 N-CA-C 111.852 -0.499 . . . . 75.45 111.852 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -73.13 -74.68 0.16 Allowed 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.302 -0.999 . . . . 70.45 108.302 174.125 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.445 ' HB3' ' HE2' ' A' ' 39' ' ' MET . 6.3 p-10 -87.48 -19.79 27.46 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.088 1.355 . . . . 74.14 111.122 -176.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -119.77 160.49 22.49 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.808 0.67 . . . . 75.23 112.808 -164.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.591 HD11 HD12 ' A' ' 79' ' ' ILE . 28.3 tp -135.99 109.77 8.11 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.415 -1.266 . . . . 73.42 107.803 170.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.44 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 36.9 m -96.21 108.44 20.91 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.317 -0.623 . . . . 74.24 109.317 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 26.3 mm -90.67 127.56 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 108.984 -0.747 . . . . 70.1 108.984 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -107.8 128.52 54.67 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 108.011 -1.107 . . . . 71.11 108.011 178.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.6 170.25 16.25 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.75 0.82 . . . . 74.53 110.106 178.35 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -85.26 134.78 34.12 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 109.515 -0.55 . . . . 74.32 109.515 173.328 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.2 ptp180 -55.1 -31.31 61.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.31 1.044 . . . . 74.33 113.656 -174.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 84.0 mtp -67.49 -26.79 66.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 122.721 0.408 . . . . 74.11 111.146 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 18.6 t -89.41 136.5 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 107.902 -1.147 . . . . 73.0 107.902 173.651 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -91.85 150.51 21.02 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.899 0.48 . . . . 74.41 111.537 -173.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -68.09 -15.71 63.71 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.243 0.617 . . . . 71.21 110.49 169.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -57.7 -31.01 65.97 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.115 0.966 . . . . 73.41 111.555 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.9 t -103.19 -17.12 15.49 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.406 0.682 . . . . 71.31 111.405 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.65 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 68.3 mt -100.96 -58.64 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 122.961 0.504 . . . . 74.02 111.13 -171.266 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.483 ' HD2' HG22 ' A' ' 21' ' ' THR . 27.7 ttpp -59.92 -46.24 98.2 Favored Pre-proline 0 CA--C 1.567 1.602 0 N-CA-C 114.606 1.336 . . . . 70.12 114.606 -170.462 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -60.29 -35.16 92.61 Favored 'Trans proline' 0 C--N 1.396 3.057 0 CA-C-N 122.002 1.751 . . . . 74.21 112.02 178.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -66.74 -46.45 75.39 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.463 -0.79 . . . . 70.54 109.837 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 50.1 mt -67.42 -45.86 84.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 O-C-N 123.979 0.799 . . . . 74.33 111.528 -177.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.69 -40.67 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 122.746 0.418 . . . . 75.22 110.694 178.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -64.27 -41.28 96.99 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.894 0.746 . . . . 64.42 110.91 177.052 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.5 -36.84 85.49 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.639 0.776 . . . . 74.21 111.398 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.508 HD12 HD11 ' A' ' 63' ' ' LEU . 8.2 mp -69.25 -33.4 73.2 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.477 0.711 . . . . 64.53 109.939 175.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.9 m -71.27 -34.6 70.85 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.176 0.59 . . . . 61.13 109.642 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -69.09 -56.64 7.09 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 122.975 0.51 . . . . 74.02 110.266 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.92 -42.94 85.85 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.681 1.192 . . . . 71.31 111.24 -173.098 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.507 HD23 ' HB3' ' A' ' 38' ' ' GLU . 95.8 mt -73.42 -34.82 65.67 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.123 0.569 . . . . 72.54 111.418 178.851 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.16 -29.27 68.12 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 122.965 0.506 . . . . 71.15 111.35 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -74.3 -34.55 63.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.802 -0.635 . . . . 74.43 110.063 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.15 35.55 53.03 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-N 115.535 -0.757 . . . . 73.43 112.358 -179.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -98.74 -179.93 4.46 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.642 0.777 . . . . 74.34 110.705 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -87.81 143.38 27.17 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.936 0.494 . . . . 74.45 110.04 174.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 7.7 p -76.3 -39.98 35.19 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 N-CA-C 109.341 -0.614 . . . . 75.05 109.341 171.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.481 HD13 HG13 ' A' ' 79' ' ' ILE . 78.5 mt -140.13 125.95 21.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.692 1.197 . . . . 73.12 108.883 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 34.1 t -79.3 87.13 5.0 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 108.784 -0.821 . . . . 74.3 108.784 173.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -67.61 -24.58 65.49 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.041 -0.981 . . . . 74.12 110.384 176.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 . . . . . 0 CA--C 1.554 1.119 0 C-N-CA 123.625 0.77 . . . . 75.31 110.13 178.708 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 109.325 -0.62 . . . . 70.43 109.325 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.65 93.78 1.16 Allowed Glycine 0 C--N 1.343 0.959 0 CA-C-N 115.664 -0.698 . . . . 70.25 111.943 176.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -75.35 111.62 10.82 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 109.433 -0.58 . . . . 65.32 109.433 175.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 17.4 t-80 -79.64 102.79 9.13 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.321 0.648 . . . . 74.33 109.437 -177.243 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -72.67 147.96 45.21 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.046 0.538 . . . . 75.14 111.621 -178.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -123.53 113.25 18.47 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.531 0.732 . . . . 74.15 109.791 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -141.18 122.98 15.31 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.726 0.81 . . . . 71.41 109.201 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -136.08 101.24 4.65 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 107.195 -1.409 . . . . 74.21 107.195 173.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.0 t -105.05 170.86 7.63 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 123.222 0.609 . . . . 71.23 110.925 -173.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.9 p-80 -157.08 143.93 18.43 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 124.773 1.229 . . . . 74.23 108.288 178.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -120.94 146.84 46.22 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 109.149 -0.686 . . . . 73.22 109.149 175.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -67.33 86.42 0.17 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.371 1.069 . . . . 72.53 109.67 -178.456 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.1 m -77.52 111.07 12.86 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.932 0.893 . . . . 74.44 109.349 -176.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -113.48 157.42 22.0 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.783 0.833 . . . . 74.33 111.251 -174.191 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -100.14 26.89 6.02 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.093 -0.958 . . . . 74.42 109.894 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.6 mt -84.0 -164.09 0.88 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.028 0.931 . . . . 72.24 111.968 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.72 134.54 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 124.715 1.206 . . . . 74.13 112.042 -163.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.1 m80 -87.71 137.28 32.47 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 125.108 1.363 . . . . 63.12 109.393 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.402 ' HB ' HG21 ' A' ' 102' ' ' ILE . 51.5 mm -121.76 117.16 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 107.019 -1.474 . . . . 73.33 107.019 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.522 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.8 ttmm -90.62 138.0 31.91 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.465 -0.939 . . . . 74.53 108.465 -178.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 85.2 m -105.55 124.61 49.84 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 108.395 -0.965 . . . . 65.45 108.395 174.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.6 mt -117.54 136.26 53.37 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 108.747 -0.834 . . . . 73.15 108.747 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.3 p -68.06 144.68 54.99 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.854 0.862 . . . . 74.44 110.432 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.3 p -126.2 147.84 61.18 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.364 1.066 . . . . 71.43 109.312 -173.368 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.94 -28.91 66.81 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 122.537 2.158 . . . . 75.22 112.033 171.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -87.16 117.23 25.77 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.196 0.999 . . . . 73.04 108.718 176.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -73.82 -29.78 62.34 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.535 0.734 . . . . 74.45 112.342 -175.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -74.35 -26.36 60.09 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 122.644 0.378 . . . . 75.33 110.588 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -90.11 158.91 17.06 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.411 0.684 . . . . 72.12 110.856 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.3 tp -158.67 123.13 4.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.335 -0.987 . . . . 72.14 108.335 168.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -84.22 129.95 34.86 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.041 0.936 . . . . 74.1 110.636 -174.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -118.57 118.56 32.01 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.257 1.023 . . . . 73.04 108.512 174.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.522 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 60.6 tp -100.88 124.65 46.87 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 109.218 -0.66 . . . . 74.33 109.218 -172.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.0 m -80.92 105.37 12.09 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.453 -0.943 . . . . 75.01 108.453 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 57.2 p -91.52 -6.16 52.97 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 112.943 0.719 . . . . 63.04 112.943 -168.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -97.15 178.02 5.39 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.075 0.95 . . . . 73.21 109.442 178.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.42 -11.72 29.16 Favored Glycine 0 N--CA 1.48 1.613 0 N-CA-C 114.208 0.443 . . . . 74.44 114.208 -175.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.464 ' HB3' HD23 ' A' ' 109' ' ' LEU . 11.4 mp0 -81.23 89.02 6.01 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.52 1.128 . . . . 72.44 109.832 175.322 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.543 ' HE1' ' HB2' ' A' ' 43' ' ' ARG . 26.7 ttt -93.53 136.45 33.8 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 108.063 -1.088 . . . . 61.34 108.063 172.438 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.409 ' HB3' HG11 ' A' ' 115' ' ' VAL . 77.5 mt -68.53 -59.51 3.09 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.933 0.493 . . . . 73.12 112.106 -167.494 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.528 ' HB2' ' HA ' ' A' ' 81' ' ' ASP . 26.3 mt-30 -117.32 171.08 8.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.721 0.808 . . . . 73.4 109.46 172.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 5.0 t -74.26 149.0 40.97 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 109.371 -0.603 . . . . 75.24 109.371 169.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.543 ' HB2' ' HE1' ' A' ' 39' ' ' MET . 22.2 ttt85 -72.79 129.54 38.42 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.542 0.337 . . . . 73.32 111.097 -174.53 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 95.66 26.94 11.01 Favored Glycine 0 C--N 1.343 0.931 0 O-C-N 123.852 0.72 . . . . 73.32 112.044 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.3 m -97.48 -177.54 3.84 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.628 0.771 . . . . 74.42 110.584 176.389 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -94.64 132.47 39.32 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 108.385 -0.969 . . . . 74.23 108.385 173.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.3 p -70.01 115.71 9.53 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.661 0.785 . . . . 70.31 110.217 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.1 mt -74.33 102.02 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 109.017 -0.734 . . . . 74.43 109.017 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 89.7 t -91.65 106.97 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.604 -0.888 . . . . 74.54 108.604 -179.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.497 HG12 ' HB3' ' A' ' 57' ' ' LEU . 66.4 mt -104.39 110.0 29.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 N-CA-C 108.065 -1.087 . . . . 71.03 108.065 -178.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.48 ' HG2' ' HB3' ' A' ' 76' ' ' SER . 54.1 mtmt -91.34 161.24 15.1 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.247 -0.649 . . . . 71.11 109.247 177.718 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.448 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 27.6 p30 -63.64 -18.27 63.76 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.0 0.92 . . . . 72.02 112.307 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -82.85 -27.17 31.0 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.67 0.788 . . . . 73.54 111.735 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.448 ' O ' HG13 ' A' ' 58' ' ' ILE . 31.1 m-20 -83.67 77.17 9.91 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.519 0.728 . . . . 72.42 111.601 -173.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -49.68 -46.31 49.78 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.196 0.998 . . . . 73.14 112.084 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -54.19 -48.02 71.43 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.495 1.118 . . . . 75.23 111.467 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.497 ' HB3' HG12 ' A' ' 50' ' ' ILE . 83.6 mt -73.6 -28.96 62.1 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 115.525 -0.761 . . . . 74.01 111.347 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.474 HG23 ' HG2' ' A' ' 65' ' ' GLN . 87.9 mt -70.81 -39.32 75.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 123.508 0.723 . . . . 63.43 110.393 178.23 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -66.16 -23.55 66.49 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.556 0.342 . . . . 74.44 111.516 174.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -72.05 -10.68 60.11 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 112.869 0.692 . . . . 75.33 112.869 172.383 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.421 ' OG ' HG12 ' A' ' 116' ' ' ILE . 17.4 m -140.83 105.31 4.87 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 122.841 0.456 . . . . 74.44 110.513 -177.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -59.31 -32.8 70.39 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.62 0.768 . . . . 74.45 110.401 174.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.2 tp -60.3 -44.73 95.15 Favored 'General case' 0 C--N 1.356 0.849 0 C-N-CA 123.988 0.915 . . . . 74.21 110.876 175.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.94 99.47 Favored 'General case' 0 C--N 1.357 0.906 0 O-C-N 123.845 0.715 . . . . 61.12 110.511 -178.419 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.474 ' HG2' HG23 ' A' ' 58' ' ' ILE . 82.8 mt-30 -57.4 -43.89 84.06 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 124.509 1.13 . . . . 75.25 110.862 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -69.23 -39.29 78.61 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 123.569 0.543 . . . . 63.23 112.026 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.446 HG23 HD22 ' A' ' 77' ' ' LEU . 59.8 mt -64.99 -49.07 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.435 0.694 . . . . 72.35 110.658 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -69.88 -27.23 64.64 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.121 0.568 . . . . 73.43 111.602 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 66.6 tp -69.66 -48.52 59.54 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.141 0.576 . . . . 74.43 110.845 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 73.8 mt-30 -74.48 -33.37 62.85 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.432 -0.804 . . . . 74.24 111.442 -177.352 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 52.4 t -142.95 94.18 6.48 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 108.759 -0.83 . . . . 74.34 108.759 -178.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -71.44 -2.01 10.61 Favored 'Trans proline' 0 C--N 1.373 1.851 0 C-N-CA 123.245 2.63 . . . . 75.41 112.733 174.935 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.69 -20.24 74.34 Favored Glycine 0 C--N 1.355 1.608 0 N-CA-C 111.687 -0.565 . . . . 74.25 111.687 177.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 85.9 t -65.39 118.3 7.68 Favored 'Isoleucine or valine' 0 C--N 1.354 0.789 0 C-N-CA 123.649 0.78 . . . . 73.01 109.713 175.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.448 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 40.5 mt-10 -82.15 -41.98 19.69 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.205 1.002 . . . . 61.52 110.871 -175.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.48 ' HB3' ' HG2' ' A' ' 51' ' ' LYS . 74.6 p -159.14 165.53 33.57 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.632 0.73 . . . . 61.51 111.999 -175.734 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.446 HD22 HG23 ' A' ' 67' ' ' ILE . 46.5 mt -129.1 127.78 42.16 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 106.905 -1.517 . . . . 72.4 106.905 176.08 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.489 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.3 ttm -103.32 109.1 20.59 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 108.11 -1.07 . . . . 75.23 108.11 173.177 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.664 HG13 HD12 ' A' ' 116' ' ' ILE . 13.6 mm -84.29 103.8 11.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 107.046 -1.465 . . . . 73.12 107.046 177.894 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.97 -168.74 43.14 Favored Glycine 0 C--O 1.245 0.816 0 N-CA-C 111.617 -0.593 . . . . 71.45 111.617 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.528 ' HA ' ' HB2' ' A' ' 41' ' ' GLN . 1.9 m-20 -76.26 -61.63 1.88 Allowed 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.678 -0.86 . . . . 74.42 108.678 -178.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -97.04 -14.73 21.42 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.112 0.965 . . . . 74.33 111.361 -178.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -134.65 156.25 49.07 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.381 0.512 . . . . 70.33 112.381 -159.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.596 HD12 HD11 ' A' ' 79' ' ' ILE . 22.6 tp -125.14 114.97 19.73 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.889 1.275 . . . . 74.22 107.921 174.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.489 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 30.8 m -102.44 108.86 20.33 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.452 -0.944 . . . . 71.32 108.452 -178.063 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.0 mm -87.4 136.95 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 107.908 -1.145 . . . . 74.43 107.908 -178.07 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -123.07 126.43 47.07 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 108.657 -0.868 . . . . 71.14 108.657 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -129.01 167.43 17.48 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.333 0.653 . . . . 74.34 109.573 177.111 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -59.71 141.94 54.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.075 0.95 . . . . 64.53 110.01 174.099 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -54.38 -38.8 66.56 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.513 0.725 . . . . 74.44 112.275 -172.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 45.3 ttp -75.81 -28.13 58.21 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.618 0.767 . . . . 75.43 111.216 -175.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.4 HG12 HD12 ' A' ' 97' ' ' ILE . 44.3 t -72.04 134.47 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 N-CA-C 108.458 -0.942 . . . . 71.13 108.458 172.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -104.13 160.78 14.57 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.149 0.579 . . . . 75.41 110.929 -176.072 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -77.94 -13.78 59.76 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.471 1.109 . . . . 72.43 113.547 -175.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -64.56 -28.36 69.59 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.28 0.632 . . . . 75.21 111.919 -171.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.2 m -95.24 -23.93 17.02 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.779 0.832 . . . . 74.32 111.546 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.4 HD12 HG12 ' A' ' 92' ' ' VAL . 50.7 mt -89.98 -48.93 14.13 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 123.813 0.845 . . . . 75.14 111.294 -168.61 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.496 ' HZ2' ' HB3' ' A' ' 98' ' ' LYS . 9.7 mtpm? -51.62 -55.51 29.05 Favored Pre-proline 0 N--CA 1.487 1.395 0 CA-C-O 117.428 -1.272 . . . . 74.21 113.282 -174.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -59.85 -38.19 81.33 Favored 'Trans proline' 0 C--N 1.396 3.049 0 CA-C-N 121.577 1.599 . . . . 75.12 112.314 -175.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.45 -48.03 57.86 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.049 0.54 . . . . 74.32 110.523 -175.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 13.1 mt -69.95 -45.23 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.49 0.716 . . . . 73.42 111.186 -178.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.402 HG21 ' HB ' ' A' ' 19' ' ' ILE . 58.1 mt -58.41 -37.4 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.067 0.547 . . . . 75.2 110.813 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -67.84 -45.77 73.7 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 123.687 0.617 . . . . 73.41 110.279 175.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.11 -33.74 72.53 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 123.867 0.867 . . . . 73.11 111.588 177.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.5 mp -74.05 -35.34 64.3 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.171 0.988 . . . . 65.05 110.654 178.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 85.5 m -72.07 -31.19 65.87 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 109.293 -0.632 . . . . 72.12 109.293 178.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.524 ' HE2' ' HA ' ' A' ' 107' ' ' LYS . 10.1 mmpt? -73.32 -52.96 12.02 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 123.932 0.893 . . . . 75.42 111.101 175.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -55.7 -53.14 60.3 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.783 0.833 . . . . 74.44 111.043 -178.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.464 HD23 ' HB3' ' A' ' 38' ' ' GLU . 78.7 mt -74.12 -10.8 59.98 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 114.844 -1.071 . . . . 73.42 111.417 -176.197 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.84 -27.4 62.87 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.706 0.402 . . . . 73.0 110.845 170.226 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -79.62 -52.04 8.49 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 107.51 -1.293 . . . . 75.44 107.51 168.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.82 -8.6 75.16 Favored Glycine 0 C--N 1.354 1.582 0 N-CA-C 115.838 1.095 . . . . 75.15 115.838 163.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.18 -70.46 0.27 Allowed 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 117.669 0.734 . . . . 61.44 111.108 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -134.1 126.09 29.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.122 0.569 . . . . 72.41 110.762 -171.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.409 HG11 ' HB3' ' A' ' 40' ' ' LEU . 3.9 p -75.35 -43.94 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 107.997 -1.112 . . . . 73.42 107.997 158.559 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.664 HD12 HG13 ' A' ' 79' ' ' ILE . 29.4 mt -132.78 142.08 43.3 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 C-N-CA 125.326 1.45 . . . . 63.41 107.218 170.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.3 p -57.61 118.92 5.73 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.056 0.942 . . . . 55.53 110.972 177.241 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.98 84.51 1.76 Allowed 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 122.091 0.948 . . . . 73.31 110.874 178.4 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 CA--C 1.555 1.153 0 C-N-CA 124.295 1.038 . . . . 64.23 109.747 -179.274 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptt? . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 110.218 -0.289 . . . . 73.51 110.218 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.19 77.54 1.36 Allowed Glycine 0 C--N 1.347 1.148 0 O-C-N 123.314 0.384 . . . . 64.41 112.455 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -80.07 80.38 6.49 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 109.246 -0.65 . . . . 72.32 109.246 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . 0.414 ' HD2' ' HB2' ' A' ' 6' ' ' HIS . 38.0 p-80 -87.97 136.52 32.93 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.463 1.105 . . . . 73.04 110.738 -176.871 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -85.31 61.97 7.2 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.893 0.854 . . . . 75.25 110.964 177.407 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.414 ' HB2' ' HD2' ' A' ' 4' ' ' HIS . 70.1 m-70 -128.79 112.28 14.0 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.215 1.006 . . . . 73.23 108.672 175.56 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.5 t-80 -130.15 135.71 48.49 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.548 1.139 . . . . 75.31 108.97 -179.221 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.1 p-80 -160.78 78.42 0.61 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.76 0.824 . . . . 64.31 109.938 178.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 60.2 p -100.6 79.01 2.04 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.459 0.703 . . . . 60.44 110.43 -179.483 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -88.93 123.57 33.41 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.235 0.614 . . . . 73.43 109.487 177.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.1 ptt? -74.24 111.34 9.32 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.17 -0.678 . . . . 71.25 109.17 174.107 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -74.36 87.6 2.03 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 108.291 -1.003 . . . . 70.43 108.291 173.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.2 t -72.25 77.65 0.99 Allowed 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.949 0.88 . . . . 73.25 109.524 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -121.27 86.46 2.58 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 106.934 -1.506 . . . . 73.21 106.934 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.0 ttt180 -83.99 119.76 25.31 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 116.017 -0.538 . . . . 74.43 109.664 -175.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -147.67 140.98 25.22 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 108.997 -0.742 . . . . 75.15 108.997 173.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.511 HD11 ' HA ' ' A' ' 106' ' ' THR . 74.7 mt -69.62 100.14 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 115.039 -0.982 . . . . 74.33 108.941 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.409 ' H ' ' HB3' ' A' ' 36' ' ' ASP . 48.2 m80 -68.32 120.54 14.61 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 124.293 1.037 . . . . 73.12 110.848 -174.371 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.4 mm -118.19 123.71 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 N-CA-C 108.079 -1.082 . . . . 73.52 108.079 -173.127 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.519 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 56.6 tptt -96.78 112.27 24.09 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.684 1.194 . . . . 75.12 109.108 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.451 HG21 ' HE3' ' A' ' 98' ' ' LYS . 59.8 m -92.49 113.47 25.76 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 108.847 -0.797 . . . . 74.45 108.847 -178.627 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.494 HD23 ' HE3' ' A' ' 20' ' ' LYS . 95.4 mt -122.26 138.01 54.64 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.625 1.17 . . . . 74.42 109.591 -171.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.4 p -81.02 147.81 30.01 Favored 'General case' 0 C--O 1.24 0.56 0 O-C-N 124.073 0.858 . . . . 71.23 110.553 -178.431 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 36.6 p -125.38 158.0 65.76 Favored Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 124.136 0.974 . . . . 75.03 109.373 -174.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.13 -32.1 30.79 Favored 'Trans proline' 0 C--N 1.389 2.679 0 C-N-CA 123.289 2.66 . . . . 71.41 113.684 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -100.71 121.46 41.7 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 108.918 -0.771 . . . . 74.21 108.918 173.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -73.82 -15.37 61.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.112 0.565 . . . . 74.01 111.303 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.436 ' O ' ' HA ' ' A' ' 87' ' ' ASN . 13.2 m120 -71.9 -19.05 61.99 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 122.655 0.382 . . . . 70.22 110.609 170.872 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -102.41 159.7 15.19 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.56 1.144 . . . . 71.32 110.082 172.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.0 tp -160.28 120.91 2.96 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.14 -0.689 . . . . 75.03 109.14 176.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.451 ' HZ1' ' HB2' ' A' ' 31' ' ' LYS . 4.9 ttmp? -82.44 120.75 25.86 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.044 0.538 . . . . 73.3 111.131 -176.45 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -105.24 111.86 24.76 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.381 -0.97 . . . . 72.34 108.381 169.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.519 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 59.5 tp -108.83 128.28 54.76 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.669 0.787 . . . . 73.25 109.665 -171.645 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 p -80.5 104.53 11.1 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.909 -0.774 . . . . 74.31 108.909 179.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.5 p -101.11 -6.74 23.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.743 0.817 . . . . 55.33 111.302 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.409 ' HB3' ' H ' ' A' ' 18' ' ' HIS . 8.0 p-10 -69.44 -37.7 77.48 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.167 0.587 . . . . 75.43 110.316 177.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.31 -12.5 4.96 Favored Glycine 0 C--N 1.349 1.292 0 C-N-CA 123.371 0.51 . . . . 71.13 113.031 178.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.508 ' HG2' ' HB3' ' A' ' 109' ' ' LEU . 9.6 tp10 -78.04 149.03 34.06 Favored 'General case' 0 C--N 1.356 0.869 0 CA-C-N 117.567 0.683 . . . . 74.21 109.965 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 7.5 tpt -111.77 142.66 43.85 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.222 0.609 . . . . 75.31 109.992 -170.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.642 HD21 HD22 ' A' ' 109' ' ' LEU . 89.8 mt -86.0 -44.42 12.35 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.409 0.684 . . . . 74.45 111.378 -177.232 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.412 ' HG3' ' H ' ' A' ' 42' ' ' THR . 6.9 tp60 -135.17 -178.0 4.9 Favored 'General case' 0 CA--C 1.561 1.376 0 N-CA-C 109.194 -0.669 . . . . 73.44 109.194 -177.278 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.412 ' H ' ' HG3' ' A' ' 41' ' ' GLN . 5.3 m -74.8 -1.01 20.18 Favored 'General case' 0 CA--C 1.568 1.651 0 N-CA-C 114.608 1.336 . . . . 75.31 114.608 -160.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.47 67.91 0.38 Allowed 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.427 1.091 . . . . 71.42 108.648 -173.046 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 153.92 43.49 0.02 OUTLIER Glycine 0 C--N 1.342 0.872 0 CA-C-N 115.195 -0.911 . . . . 74.34 112.236 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.2 t -129.38 176.92 7.56 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.384 0.674 . . . . 73.23 109.817 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.28 -176.31 3.26 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.301 1.041 . . . . 71.44 110.185 177.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.5 m -73.49 92.88 1.93 Allowed 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 109.355 -0.609 . . . . 75.22 109.355 173.294 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.553 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 46.9 mt -75.35 97.87 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 108.758 -0.83 . . . . 74.34 108.758 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.4 t -86.83 107.27 16.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.017 -1.105 . . . . 74.33 108.017 -176.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.6 mt -102.59 108.4 24.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 107.884 -1.154 . . . . 73.53 107.884 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -95.66 155.96 16.53 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.195 0.598 . . . . 65.42 109.66 -176.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.432 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 34.5 p30 -60.47 -18.87 54.27 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.563 0.745 . . . . 72.42 112.364 -178.772 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.5 p -77.56 -41.27 39.53 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.774 0.83 . . . . 74.25 111.262 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -86.69 79.75 8.77 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.502 0.721 . . . . 75.33 110.552 -171.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -66.53 -22.82 66.17 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.28 -0.873 . . . . 74.32 112.21 -173.691 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -57.5 -46.88 83.24 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 121.052 0.453 . . . . 74.11 110.377 178.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.3 mt -73.2 -35.65 66.38 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.662 0.785 . . . . 70.15 110.523 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 72.1 mt -61.27 -42.54 93.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.337 1.055 . . . . 62.21 110.283 177.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.43 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 83.1 m-20 -69.45 -29.19 66.83 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.159 0.584 . . . . 72.54 111.875 177.833 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.524 ' HB3' HG22 ' A' ' 116' ' ' ILE . 24.7 m80 -73.9 -33.14 63.88 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.142 0.577 . . . . 74.12 111.525 175.646 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.0 p -110.97 92.24 3.97 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 108.798 -0.816 . . . . 71.45 108.798 176.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -57.46 -23.4 49.61 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.718 0.807 . . . . 71.35 111.352 -175.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.4 tp -58.12 -46.73 85.09 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.062 1.345 . . . . 72.2 110.872 171.665 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.72 -39.27 93.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.939 0.896 . . . . 71.14 110.707 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.43 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 95.6 mt-30 -55.06 -47.84 74.31 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 123.651 0.594 . . . . 72.45 109.827 175.179 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -65.61 -45.31 83.64 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 115.135 -0.939 . . . . 74.1 112.845 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 69.2 mt -65.09 -49.1 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 123.112 0.565 . . . . 73.52 110.663 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -68.24 -30.12 69.1 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 116.107 -0.497 . . . . 75.41 111.372 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 41.0 tp -73.32 -46.99 46.17 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.107 0.563 . . . . 74.43 111.679 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -83.27 -17.42 42.65 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.316 0.647 . . . . 74.35 111.594 -173.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 51.6 t -141.96 105.58 5.73 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 123.352 0.661 . . . . 72.02 109.604 172.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.45 -8.53 22.77 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.949 2.433 . . . . 73.41 112.803 176.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.528 ' HA3' HG12 ' A' ' 92' ' ' VAL . . . -76.61 -21.9 73.78 Favored Glycine 0 C--N 1.345 1.037 0 CA-C-N 116.57 -0.286 . . . . 71.01 113.29 -178.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.53 122.68 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 122.989 0.516 . . . . 65.05 109.673 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.432 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 11.1 pt-20 -93.04 -33.77 13.97 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.755 0.822 . . . . 73.23 111.23 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.9 p -161.9 160.29 27.76 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.459 0.647 . . . . 63.44 112.023 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.408 HD22 HD11 ' A' ' 86' ' ' ILE . 40.7 mt -121.08 139.23 53.6 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.155 -1.424 . . . . 74.12 107.155 174.671 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.541 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 48.6 ttm -113.06 109.22 18.47 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 107.215 -1.402 . . . . 72.4 107.215 173.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.605 HG23 HG11 ' A' ' 115' ' ' VAL . 39.8 mm -92.49 127.18 44.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 109.342 -0.614 . . . . 72.21 109.342 -176.138 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -114.22 175.61 16.38 Favored Glycine 0 C--O 1.241 0.566 0 N-CA-C 109.677 -1.369 . . . . 42.01 109.677 166.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.406 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 23.5 m-20 -72.71 -44.61 61.5 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.582 0.706 . . . . 65.23 110.468 177.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -104.38 -39.51 6.42 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 125.014 1.326 . . . . 65.2 110.933 -174.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 18.1 p90 -111.21 155.58 22.73 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.292 0.637 . . . . 75.12 111.201 -175.467 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.457 HD21 HD12 ' A' ' 86' ' ' ILE . 54.3 tp -120.79 150.45 40.99 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 107.425 -1.324 . . . . 74.43 107.425 171.209 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.541 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 50.7 m -141.37 109.46 5.81 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.218 0.607 . . . . 53.24 109.76 175.798 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.468 HG13 HD13 ' A' ' 101' ' ' ILE . 29.5 mm -88.76 139.53 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 109.242 -0.651 . . . . 74.32 109.242 -178.685 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.436 ' HA ' ' O ' ' A' ' 28' ' ' ASN . 33.5 m-80 -118.35 133.82 55.56 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.454 0.702 . . . . 75.11 109.571 175.554 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.478 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -128.11 168.74 14.95 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.585 0.754 . . . . 73.42 109.978 -178.832 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.403 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 14.1 t70 -72.95 149.5 43.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.274 0.63 . . . . 71.55 110.179 173.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -50.14 -41.04 48.09 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.653 1.181 . . . . 71.13 114.184 -172.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 20.0 ptp -83.41 -18.03 40.14 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 122.752 0.421 . . . . 75.34 111.75 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.528 HG12 ' HA3' ' A' ' 73' ' ' GLY . 27.4 t -81.46 127.65 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.068 0.547 . . . . 72.44 109.545 -171.592 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -86.8 130.68 34.37 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.785 0.834 . . . . 74.21 110.601 -169.75 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.478 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 45.4 m95 -59.16 -31.41 68.96 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.507 0.723 . . . . 75.03 112.141 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -61.35 -26.19 67.66 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 122.767 0.427 . . . . 73.35 111.445 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.7 t -86.99 -18.73 29.97 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.698 0.799 . . . . 44.35 111.367 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.441 HD13 HG11 ' A' ' 92' ' ' VAL . 10.9 mt -104.09 -44.16 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.348 0 C-N-CA 123.043 0.537 . . . . 74.25 111.586 -170.51 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.451 ' HE3' HG21 ' A' ' 21' ' ' THR . 54.5 mtpt -52.91 -52.18 67.46 Favored Pre-proline 0 N--CA 1.491 1.595 0 C-N-CA 124.963 1.305 . . . . 74.24 113.706 -172.636 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -56.5 -40.07 87.0 Favored 'Trans proline' 0 C--N 1.393 2.919 0 C-N-CA 121.909 1.74 . . . . 74.24 112.049 -178.31 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -61.84 -53.76 51.44 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.79 -1.096 . . . . 75.31 110.03 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.468 HD13 HG13 ' A' ' 86' ' ' ILE . 48.2 mt -61.93 -51.06 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.077 0.951 . . . . 75.11 111.833 -176.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 83.2 mt -58.56 -40.17 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 123.308 0.643 . . . . 73.3 110.824 -177.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -66.99 -42.51 84.9 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.944 0.498 . . . . 71.12 110.74 178.352 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.7 mt -65.79 -35.57 81.08 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.163 0.985 . . . . 74.51 111.757 178.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.36 -35.94 80.69 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.687 0.795 . . . . 65.11 109.95 174.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.511 ' HA ' HD11 ' A' ' 17' ' ' ILE . 26.3 m -74.26 -29.83 61.85 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.073 0.549 . . . . 74.02 110.054 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -65.53 -52.41 52.81 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.456 0.702 . . . . 73.24 110.31 174.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -66.88 -52.62 41.24 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.306 -0.861 . . . . 73.42 111.744 -174.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.642 HD22 HD21 ' A' ' 40' ' ' LEU . 95.4 mt -67.56 -18.03 64.86 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.551 -0.75 . . . . 64.21 111.528 -174.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.33 -19.4 65.45 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.717 0.807 . . . . 73.21 112.032 174.017 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -74.73 -29.23 61.1 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.992 0.517 . . . . 73.32 110.434 173.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.97 28.04 63.32 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.947 -0.57 . . . . 74.33 112.85 -177.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -115.81 -178.65 3.44 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.216 1.006 . . . . 62.12 110.064 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -70.14 169.47 13.49 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.189 0.596 . . . . 63.43 110.336 172.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.605 HG11 HG23 ' A' ' 79' ' ' ILE . 7.1 p -67.54 -36.13 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.896 0.878 . . . . 75.31 109.707 175.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.524 HG22 ' HB3' ' A' ' 60' ' ' HIS . 83.8 mt -98.96 137.73 25.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 C-N-CA 124.644 1.178 . . . . 72.53 107.913 173.248 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 64.7 m -59.42 105.33 0.34 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 122.855 0.462 . . . . 65.32 109.796 175.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -63.33 -50.68 69.05 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.366 1.066 . . . . 74.25 110.839 -177.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 . . . . . 0 C--O 1.254 1.297 0 C-N-CA 125.116 1.366 . . . . 74.34 110.938 -177.182 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 ptp . . . . . 0 N--CA 1.48 1.028 0 CA-C-O 120.394 0.14 . . . . 73.43 110.985 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -76.48 75.18 1.64 Allowed Glycine 0 C--N 1.353 1.497 0 N-CA-C 112.191 -0.363 . . . . 74.11 112.191 178.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 44.6 t-80 -71.79 120.13 16.94 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.875 0.87 . . . . 75.5 109.665 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -128.58 92.56 3.44 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.332 0.653 . . . . 73.03 110.826 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -140.23 131.47 26.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.824 1.25 . . . . 74.02 108.721 168.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.4 p-80 -154.19 162.84 40.92 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.933 0.493 . . . . 73.32 110.796 179.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 47.3 t60 -164.66 94.16 0.68 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.329 0.652 . . . . 73.23 110.456 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 29.7 p-80 -86.61 129.06 35.01 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.259 0.624 . . . . 73.51 109.515 170.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.1 m -158.47 109.11 2.11 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.988 0.915 . . . . 72.01 109.355 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -105.61 102.54 11.99 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.345 -0.613 . . . . 72.43 109.345 174.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.8 ttt -79.21 84.93 5.12 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.763 -0.828 . . . . 73.23 108.763 175.251 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -70.59 122.81 20.45 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.302 0.641 . . . . 61.23 109.592 175.142 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.2 t -70.82 154.2 42.05 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.372 0.669 . . . . 71.22 110.375 175.479 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -133.42 152.78 51.95 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 108.48 -0.933 . . . . 74.5 108.48 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 62.18 79.38 0.26 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.996 1.318 . . . . 74.22 109.775 -169.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.426 HD22 ' H ' ' A' ' 16' ' ' LEU . 1.9 pt? -110.65 127.64 55.36 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 114.387 -1.279 . . . . 72.31 107.735 174.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.7 mt -76.6 113.08 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.038 0.535 . . . . 75.23 110.747 -170.123 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -77.31 112.92 14.53 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.254 1.021 . . . . 72.54 110.627 -175.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.449 ' HB ' HG21 ' A' ' 102' ' ' ILE . 50.1 mm -121.63 119.24 58.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 106.69 -1.596 . . . . 72.35 106.69 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -112.25 130.88 55.78 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.843 -1.169 . . . . 73.22 107.843 178.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.1 m -111.01 112.58 24.5 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.469 -0.567 . . . . 71.42 109.469 -175.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -97.62 139.67 33.17 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 123.396 0.678 . . . . 73.11 109.95 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 64.5 p -84.65 150.79 24.9 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.765 0.826 . . . . 75.53 110.223 -176.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 54.4 p -126.66 145.85 54.8 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.589 0.756 . . . . 63.14 109.587 -174.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -52.74 -41.08 71.99 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 123.203 2.602 . . . . 73.33 113.246 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -73.53 111.9 9.1 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.2 0.6 . . . . 60.44 109.858 172.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -71.99 -16.99 62.08 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.239 1.016 . . . . 74.03 112.368 -172.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -89.73 6.75 40.13 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.737 0.815 . . . . 63.32 111.5 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -135.47 159.34 41.9 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.391 1.077 . . . . 63.22 109.353 174.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.9 tp -156.86 127.55 6.66 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.314 -0.625 . . . . 74.52 109.314 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.54 114.7 26.97 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.367 0.667 . . . . 73.04 111.258 -173.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -103.19 125.35 49.83 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.748 1.219 . . . . 74.51 108.2 170.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.5 tp -130.71 136.69 49.02 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.501 0.72 . . . . 75.41 109.34 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.4 m -91.05 112.41 24.3 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.77 -0.826 . . . . 72.51 108.77 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.2 p -75.9 -5.74 47.56 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.249 0.62 . . . . 73.12 112.423 -174.497 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -71.0 -31.26 67.74 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.174 0.59 . . . . 65.43 110.141 169.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.96 36.28 3.23 Favored Glycine 0 C--N 1.344 1.01 0 CA-C-N 115.475 -0.784 . . . . 72.54 111.986 -174.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -83.71 81.87 8.57 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.545 0.688 . . . . 74.33 109.449 178.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.41 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 52.2 ttm -74.67 133.14 42.13 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 114.97 -1.013 . . . . 72.24 109.871 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.534 HD11 ' HB2' ' A' ' 84' ' ' LEU . 75.4 mt -78.12 -57.67 3.66 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.238 0.615 . . . . 72.52 110.494 -174.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.515 ' HB2' ' HA ' ' A' ' 81' ' ' ASP . 10.1 mm100 -103.97 -157.84 0.63 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.387 1.075 . . . . 75.04 109.143 -177.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 90.5 m -86.37 147.65 25.94 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.935 0.894 . . . . 73.41 109.012 171.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -61.17 118.17 6.49 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-N 118.671 0.669 . . . . 75.14 110.468 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 99.82 18.17 23.54 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-O 119.708 -0.496 . . . . 64.51 113.219 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 73.7 m -78.71 172.62 13.46 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 117.396 0.598 . . . . 73.53 111.779 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.2 mmpt? -87.82 154.07 20.84 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.103 0.961 . . . . 73.54 110.329 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.4 m -77.65 91.9 4.06 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.571 0.748 . . . . 75.13 109.63 177.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.444 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 64.5 mt -73.47 109.15 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.311 1.044 . . . . 74.11 109.678 -175.925 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.2 t -87.04 110.06 19.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 109.225 -0.657 . . . . 74.24 109.225 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 76.0 mt -106.61 107.83 23.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 107.556 -1.275 . . . . 65.41 107.556 174.361 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -92.37 165.26 13.16 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 109.68 -0.489 . . . . 74.3 109.68 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -64.79 -24.46 67.56 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.507 0.723 . . . . 75.41 111.759 178.184 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.0 t -79.48 -22.88 43.47 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.403 0.681 . . . . 74.24 110.672 176.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -90.16 63.18 5.73 Favored 'General case' 0 C--N 1.354 0.771 0 C-N-CA 123.604 0.762 . . . . 64.45 109.894 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.477 ' HA ' HD11 ' A' ' 58' ' ' ILE . 38.1 tt0 -65.45 -23.82 67.02 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.897 -0.592 . . . . 75.35 110.466 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -61.67 -40.65 95.7 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.092 0.957 . . . . 62.31 111.278 175.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 96.0 mt -71.86 -41.38 68.16 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.273 0.629 . . . . 74.1 110.007 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.477 HD11 ' HA ' ' A' ' 55' ' ' GLU . 79.9 mt -59.2 -37.76 70.48 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 124.356 1.062 . . . . 73.12 111.103 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -58.47 -34.43 70.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.48 0.712 . . . . 74.25 111.699 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 53.0 m80 -94.95 13.71 24.07 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.031 0.932 . . . . 75.44 111.525 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.4 m -138.4 96.51 3.18 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.726 0.81 . . . . 72.4 109.793 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -55.73 -44.89 77.94 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.549 1.139 . . . . 74.51 112.388 -177.731 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.538 ' HB3' HG23 ' A' ' 115' ' ' VAL . 51.1 tp -61.1 -39.52 90.26 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.355 -0.839 . . . . 75.35 111.464 177.39 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.65 -43.52 96.52 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.906 0.483 . . . . 73.03 111.396 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -56.29 -47.56 78.41 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 123.993 0.808 . . . . 75.33 110.612 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.513 ' HB3' HD22 ' A' ' 104' ' ' LEU . 27.2 mm-40 -62.14 -44.98 95.43 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.754 0.822 . . . . 74.13 113.09 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.408 HG23 HD22 ' A' ' 77' ' ' LEU . 81.3 mt -65.13 -49.93 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.255 0.622 . . . . 75.21 110.863 -177.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -69.56 -26.21 64.38 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 111.988 0.366 . . . . 74.1 111.988 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.8 tp -72.5 -60.09 2.4 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 122.993 0.517 . . . . 74.52 111.268 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -81.35 -21.57 39.03 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.765 -0.652 . . . . 70.22 111.398 -171.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.509 ' SG ' HG21 ' A' ' 97' ' ' ILE . 60.1 m -124.44 92.73 47.6 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 123.612 0.765 . . . . 74.24 109.472 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.03 -10.75 26.51 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 123.004 2.47 . . . . 73.13 113.337 -177.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.418 ' HA3' HG13 ' A' ' 92' ' ' VAL . . . -100.6 46.63 1.32 Allowed Glycine 0 C--N 1.348 1.244 0 C-N-CA 122.759 0.219 . . . . 32.21 112.721 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 94.8 t -122.26 125.34 72.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 123.742 0.817 . . . . 74.32 109.187 170.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -87.82 -42.43 12.56 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.76 0.424 . . . . 75.15 111.158 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.1 t -152.98 165.51 35.33 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.061 0.458 . . . . 73.34 111.272 -172.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.408 HD22 HG23 ' A' ' 67' ' ' ILE . 79.1 mt -128.62 130.02 46.7 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 124.61 1.164 . . . . 75.11 108.143 175.851 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.525 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.7 ttm -107.72 101.88 11.15 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.53 -1.285 . . . . 73.24 107.53 174.801 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.444 ' HB ' ' HB ' ' A' ' 48' ' ' ILE . 45.8 mm -83.55 100.69 7.31 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 108.221 -1.029 . . . . 72.44 108.221 -176.061 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -83.06 172.06 51.09 Favored Glycine 0 C--O 1.248 0.973 0 N-CA-C 109.715 -1.354 . . . . 75.23 109.715 174.412 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.515 ' HA ' ' HB2' ' A' ' 41' ' ' GLN . 10.9 p-10 -70.07 -51.76 29.29 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 110.122 -0.325 . . . . 74.11 110.122 -178.415 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -99.58 -39.82 8.12 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.229 0.612 . . . . 74.21 109.847 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -95.76 163.03 13.35 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.522 0.729 . . . . 74.35 111.67 -170.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.534 ' HB2' HD11 ' A' ' 40' ' ' LEU . 67.3 tp -130.03 113.42 14.53 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.747 -0.834 . . . . 73.24 108.747 175.255 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.525 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 51.3 m -105.69 109.93 22.06 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.207 -0.664 . . . . 64.22 109.207 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 28.9 mm -87.83 133.76 29.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 107.77 -1.196 . . . . 74.31 107.77 179.587 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -114.44 134.0 55.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.417 0.687 . . . . 72.02 109.32 -177.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.497 ' NZ ' HD12 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -140.07 174.6 10.35 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.432 0.634 . . . . 75.02 111.426 175.285 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -86.49 147.73 25.85 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.917 -1.038 . . . . 70.03 109.08 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.6 ptt180 -76.81 -1.94 30.75 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 112.826 0.676 . . . . 75.21 112.826 -173.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 66.9 mtt -79.35 -24.49 42.68 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 109.854 -0.424 . . . . 74.33 109.854 172.63 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.418 HG13 ' HA3' ' A' ' 73' ' ' GLY . 60.1 t -98.29 142.27 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.909 0.883 . . . . 64.24 108.717 177.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -88.82 142.35 27.74 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.864 0.866 . . . . 74.31 111.556 -175.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.402 ' CD2' ' HE2' ' A' ' 88' ' ' LYS . 52.7 m95 -71.54 -45.37 62.51 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.967 0.507 . . . . 73.31 111.064 172.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -50.44 -32.21 17.22 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 124.56 1.144 . . . . 74.32 112.572 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.4 m -73.97 -54.32 8.16 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-N 115.467 -0.788 . . . . 75.04 110.839 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.509 HG21 ' SG ' ' A' ' 71' ' ' CYS . 10.5 mt -81.33 -22.4 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 124.318 1.047 . . . . 75.14 112.376 -170.745 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.69 -50.57 84.7 Favored Pre-proline 0 CA--C 1.557 1.246 0 C-N-CA 124.316 1.046 . . . . 74.41 113.512 -168.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -62.3 -28.44 78.85 Favored 'Trans proline' 0 C--N 1.385 2.49 0 C-N-CA 121.564 1.509 . . . . 65.33 111.97 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -70.68 -40.31 73.02 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.973 0.909 . . . . 74.21 111.219 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 71.4 mt -68.99 -45.9 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 N-CA-C 109.811 -0.44 . . . . 73.45 109.811 178.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.449 HG21 ' HB ' ' A' ' 19' ' ' ILE . 88.4 mt -53.57 -40.63 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.585 0.754 . . . . 74.02 110.597 175.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -74.37 -37.57 63.41 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.523 -0.762 . . . . 52.35 111.505 -179.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.513 HD22 ' HB3' ' A' ' 66' ' ' GLN . 48.8 mt -64.75 -33.43 75.96 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.662 0.785 . . . . 64.31 111.6 175.031 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.36 -25.03 62.2 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.716 -0.675 . . . . 74.34 110.275 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 26.0 m -79.85 -33.76 39.91 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 109.05 -0.722 . . . . 65.33 109.05 176.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -64.67 -50.57 66.52 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.285 0.634 . . . . 75.23 111.08 175.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.51 ' HG3' ' HB2' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -68.16 -56.13 9.87 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.98 0.912 . . . . 75.25 110.431 -173.216 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' A' ' 113' ' ' GLU . 66.9 mt -67.76 -11.96 59.54 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.679 0.792 . . . . 73.3 112.527 -173.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.07 -39.59 93.44 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.263 0.625 . . . . 65.4 110.386 173.273 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -94.26 -37.7 11.39 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.488 -0.778 . . . . 73.23 110.516 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.55 160.33 26.92 Favored Glycine 0 C--N 1.349 1.295 0 N-CA-C 114.243 0.457 . . . . 61.11 114.243 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.467 ' HA ' HD22 ' A' ' 109' ' ' LEU . 0.2 OUTLIER -86.29 -16.98 35.82 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.429 1.092 . . . . 74.33 111.604 179.904 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -67.3 107.95 2.57 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.345 0.658 . . . . 73.35 111.262 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.538 HG23 ' HB3' ' A' ' 63' ' ' LEU . 2.9 p -73.71 -34.07 39.98 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 CA-C-N 115.459 -0.791 . . . . 74.2 109.91 170.164 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.536 HG12 HG13 ' A' ' 115' ' ' VAL . 22.4 mm -105.52 69.18 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.552 0.741 . . . . 74.15 110.306 -178.099 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 73.6 m 62.72 157.15 0.06 Allowed 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 125.428 1.491 . . . . 71.31 114.75 173.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.477 ' HZ3' ' HB2' ' A' ' 118' ' ' LYS . 0.2 OUTLIER -159.23 11.35 0.14 Allowed 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.606 0.965 . . . . 74.53 113.606 -178.883 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.561 1.369 0 N-CA-C 109.419 -0.585 . . . . 75.43 109.419 176.804 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.422 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.4 mpt? . . . . . 0 N--CA 1.483 1.182 0 N-CA-C 109.807 -0.442 . . . . 73.44 109.807 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -116.71 -82.55 0.94 Allowed Glycine 0 C--N 1.342 0.891 0 N-CA-C 111.626 -0.589 . . . . 62.0 111.626 178.599 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.1 m80 57.35 23.13 8.55 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.49 1.116 . . . . 73.43 113.156 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -113.44 78.54 1.15 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 122.215 1.007 . . . . 71.0 109.624 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 43.1 t60 -125.31 88.09 2.81 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 107.539 -1.282 . . . . 74.32 107.539 177.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -106.36 112.11 24.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.71 -0.677 . . . . 73.02 110.847 -170.265 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.8 m-70 -131.15 118.85 21.07 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.361 1.064 . . . . 74.25 108.349 171.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -130.9 58.99 1.68 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 107.801 -1.185 . . . . 70.41 107.801 177.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.7 m -121.84 92.75 3.8 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 114.909 -1.041 . . . . 73.04 109.568 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.3 m-70 -133.2 84.5 2.14 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 108.203 -1.036 . . . . 73.44 108.203 178.168 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 94.4 mmm -73.21 82.67 1.34 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.36 -0.608 . . . . 74.32 109.36 176.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -98.77 105.95 18.15 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.69 -0.686 . . . . 73.3 109.297 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.5 p -168.02 125.83 1.16 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 124.0 0.92 . . . . 65.11 109.202 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -160.66 115.08 2.15 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.714 0.806 . . . . 75.03 109.019 175.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.69 167.53 12.45 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.967 0.907 . . . . 73.52 109.731 -176.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -137.1 139.94 41.6 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 108.007 -1.108 . . . . 74.52 108.007 168.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.556 HG21 ' HB2' ' A' ' 109' ' ' LEU . 1.6 mp -73.67 93.09 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 107.328 -1.36 . . . . 73.35 107.328 176.617 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -67.65 131.73 46.15 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.284 -0.871 . . . . 74.22 109.224 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.541 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.7 mm -112.78 124.9 69.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 N-CA-C 105.975 -1.861 . . . . 70.3 105.975 -178.93 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.447 ' HD3' HD22 ' A' ' 33' ' ' LEU . 51.3 tttp -90.75 159.7 16.19 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.318 -1.364 . . . . 75.33 107.318 -179.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.493 HG23 ' HE3' ' A' ' 98' ' ' LYS . 41.2 m -137.83 133.17 33.63 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.893 -0.78 . . . . 75.52 108.893 176.882 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.532 HD11 HD23 ' A' ' 33' ' ' LEU . 50.6 mt -117.48 139.23 51.2 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 107.474 -1.306 . . . . 51.44 107.474 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 62.5 p -69.98 155.79 40.06 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 122.64 0.376 . . . . 71.04 110.296 175.271 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.0 p -131.35 149.53 73.86 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 124.31 1.044 . . . . 64.03 108.94 -177.337 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.3 -9.61 26.31 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 122.538 2.158 . . . . 74.52 113.308 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.402 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 7.9 t30 -101.02 128.33 47.1 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.42 0.688 . . . . 71.15 109.446 174.824 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -68.0 -35.87 79.04 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.544 1.137 . . . . 73.02 113.315 -175.679 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -78.43 -16.01 58.04 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.993 0.517 . . . . 73.42 111.111 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.434 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -102.23 151.44 22.21 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.823 0.849 . . . . 51.11 110.155 -178.189 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.9 tp -160.74 118.82 2.49 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 108.112 -1.07 . . . . 73.54 108.112 172.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -90.69 130.91 36.64 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 121.489 0.662 . . . . 71.31 110.531 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -104.13 119.62 39.35 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 107.249 -1.389 . . . . 74.52 107.249 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.532 HD23 HD11 ' A' ' 22' ' ' LEU . 23.6 tp -98.54 123.47 42.73 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.517 -0.92 . . . . 74.15 108.517 -172.228 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.4 m -90.53 105.78 18.05 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 108.47 -0.937 . . . . 74.44 108.47 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.5 t -136.83 8.06 3.0 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 115.745 -0.661 . . . . 75.42 111.416 -174.199 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -145.63 141.25 27.98 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.146 -1.057 . . . . 74.32 108.146 175.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . 0.542 ' HA3' HG13 ' A' ' 17' ' ' ILE . . . 81.91 -90.05 1.45 Allowed Glycine 0 C--N 1.34 0.79 0 N-CA-C 110.816 -0.914 . . . . 75.13 110.816 -173.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -134.26 -179.59 5.66 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.128 0.971 . . . . 63.31 109.958 178.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 12.3 ptp -111.88 162.14 15.62 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.128 0.971 . . . . 75.3 108.422 161.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.41 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 74.4 mt -70.66 -38.71 73.83 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.783 0.833 . . . . 74.3 111.731 -175.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.717 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.6 tt0 -148.48 140.84 24.23 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.735 -1.209 . . . . 75.42 107.735 -178.161 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 m -60.22 107.69 0.68 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.617 0.767 . . . . 73.33 110.65 -176.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.501 ' HA ' ' HB3' ' A' ' 81' ' ' ASP . 11.9 ttp180 -55.58 107.58 0.35 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.892 0.877 . . . . 74.11 112.388 -167.467 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 165.01 -8.38 0.07 OUTLIER Glycine 0 C--N 1.338 0.673 0 CA-C-N 114.56 -1.2 . . . . 74.34 113.194 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.6 t -103.44 -168.57 1.52 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.679 0.792 . . . . 73.23 110.064 176.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.4 178.61 5.56 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.597 1.159 . . . . 73.32 111.513 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 55.2 m -91.79 128.91 37.8 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.892 0.877 . . . . 72.35 109.818 173.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 mp -96.74 119.52 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 124.197 0.999 . . . . 75.24 109.016 -178.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -91.49 110.33 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 CA-C-N 118.447 0.567 . . . . 73.32 109.786 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.518 HD11 HD11 ' A' ' 116' ' ' ILE . 67.1 mt -101.95 109.74 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.46 1.104 . . . . 74.4 108.81 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -93.12 151.05 20.09 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.214 0.606 . . . . 73.5 109.882 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.413 ' HA ' HD11 ' A' ' 58' ' ' ILE . 47.3 p30 -66.95 -24.32 66.06 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.387 0.675 . . . . 73.54 112.137 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.8 t -84.52 -7.07 59.39 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.975 0.91 . . . . 75.21 112.008 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -111.66 88.7 2.86 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.272 0.629 . . . . 73.24 109.795 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.44 -35.26 51.85 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.273 1.029 . . . . 75.21 111.653 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -57.3 -53.39 58.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.511 1.124 . . . . 74.24 111.094 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.8 -34.41 78.28 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.417 -0.81 . . . . 75.44 111.231 -176.721 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.489 HG23 ' HG2' ' A' ' 65' ' ' GLN . 66.6 mt -70.09 -47.33 68.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.188 0.995 . . . . 74.03 110.217 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -62.29 -19.33 63.15 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.473 1.109 . . . . 72.54 112.683 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.422 ' HE1' ' HA ' ' A' ' 116' ' ' ILE . 59.1 t-80 -69.25 -54.86 12.56 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-O 121.334 0.587 . . . . 74.33 109.732 172.727 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.3 m -94.67 107.82 19.81 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.103 -0.953 . . . . 72.53 110.478 -172.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.427 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 38.7 ttpt -59.1 -33.27 70.63 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.018 0.527 . . . . 74.03 109.741 174.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 30.6 tp -59.23 -46.52 88.25 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.619 1.167 . . . . 75.3 110.637 177.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.09 -47.02 84.49 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 123.85 0.86 . . . . 71.41 110.658 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.489 ' HG2' HG23 ' A' ' 58' ' ' ILE . 65.9 mt-30 -59.1 -39.94 83.77 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 124.58 1.175 . . . . 74.21 110.967 -178.795 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.54 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 17.0 mm100 -66.73 -45.77 77.59 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 118.513 -0.756 . . . . 64.33 110.891 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -58.33 -43.61 86.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 CA-C-N 118.63 0.65 . . . . 72.05 110.68 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -68.58 -32.79 72.95 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.387 0.675 . . . . 74.41 111.342 175.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.6 tp -68.16 -34.8 76.99 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.439 0.696 . . . . 74.2 110.817 175.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.54 ' HG2' ' O ' ' A' ' 66' ' ' GLN . 7.1 mm100 -75.16 -41.31 58.4 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 120.983 0.421 . . . . 75.34 110.007 -178.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.44 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 61.0 m -151.43 100.57 2.97 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 124.136 0.974 . . . . 53.34 108.503 -176.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -67.25 1.95 2.61 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 123.381 2.721 . . . . 75.13 114.349 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.58 -5.42 89.92 Favored Glycine 0 C--N 1.352 1.457 0 CA-C-O 119.749 -0.473 . . . . 71.45 113.544 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.1 t -74.09 127.04 35.69 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 123.063 0.545 . . . . 74.45 110.243 177.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -84.79 -45.5 12.3 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.934 0.894 . . . . 73.13 110.874 -177.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.9 p -156.92 166.2 34.02 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.789 0.804 . . . . 74.44 110.923 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.1 mt -126.18 127.62 45.98 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 107.157 -1.423 . . . . 74.13 107.157 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.583 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.3 ttm -103.56 96.75 6.94 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 106.989 -1.485 . . . . 74.15 106.989 173.516 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 29.4 mm -77.88 101.01 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 114.893 -1.049 . . . . 74.02 108.685 -175.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.88 174.24 44.07 Favored Glycine 0 C--O 1.247 0.967 0 N-CA-C 110.31 -1.116 . . . . 64.14 110.31 176.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.717 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 2.5 m-20 -76.64 -56.67 4.4 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.791 0.805 . . . . 74.24 109.808 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -101.9 -7.79 22.15 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.474 -1.239 . . . . 65.13 111.114 -174.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -139.9 172.32 12.94 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.452 0.701 . . . . 74.55 110.654 -176.313 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.41 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 35.7 tp -143.75 106.93 4.52 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.872 0.469 . . . . 75.22 110.13 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.583 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 61.0 m -95.8 103.49 15.38 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.851 -0.796 . . . . 70.2 108.851 -176.346 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.612 HG13 HD13 ' A' ' 101' ' ' ILE . 15.7 mm -87.88 122.55 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.554 -0.906 . . . . 74.11 108.554 -177.101 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -108.35 113.57 26.75 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 108.153 -1.054 . . . . 74.13 108.153 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.74 177.55 5.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.45 0.7 . . . . 74.43 110.446 -175.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -77.16 136.85 38.61 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.184 0.593 . . . . 75.03 110.109 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -67.74 -22.18 65.24 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 112.86 0.689 . . . . 70.44 112.86 -171.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 71.8 mtm -79.81 -22.89 42.51 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.866 0.466 . . . . 71.23 110.888 176.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 38.5 t -89.56 141.72 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.028 -1.101 . . . . 73.54 108.028 176.681 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 68.7 m80 -110.9 157.24 20.09 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.612 0.597 . . . . 74.32 112.612 -171.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -70.74 -25.22 62.83 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.19 0.996 . . . . 71.24 112.93 -176.423 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -59.2 -24.87 63.48 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 120.977 0.417 . . . . 71.52 111.043 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 17.8 m -88.87 -42.29 11.94 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.283 1.033 . . . . 74.35 111.739 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.453 HG22 HD12 ' A' ' 101' ' ' ILE . 7.6 mt -91.33 -50.02 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 122.905 0.482 . . . . 72.34 111.039 -165.602 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.493 ' HE3' HG23 ' A' ' 21' ' ' THR . 85.8 tttt -50.95 -51.36 67.96 Favored Pre-proline 0 CA--C 1.566 1.561 0 N-CA-C 114.509 1.3 . . . . 74.31 114.509 -174.526 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -57.26 -35.15 98.85 Favored 'Trans proline' 0 C--N 1.398 3.143 0 C-N-CA 121.884 1.723 . . . . 74.23 112.147 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 26.0 mm-40 -67.53 -46.02 74.01 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.159 -0.928 . . . . 73.24 110.268 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.612 HD13 HG13 ' A' ' 86' ' ' ILE . 76.7 mt -61.53 -47.11 94.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.611 0.764 . . . . 74.42 110.565 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.541 HG23 ' HB ' ' A' ' 19' ' ' ILE . 76.8 mt -57.86 -45.55 87.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 123.659 0.599 . . . . 74.41 110.25 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -59.37 -48.0 83.3 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.851 0.86 . . . . 74.3 111.273 178.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 95.7 mt -62.88 -40.0 96.18 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.033 0.933 . . . . 74.13 111.726 -178.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 9.4 mp -71.74 -27.9 63.31 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.758 0.823 . . . . 74.42 110.933 178.453 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 97.5 m -74.25 -47.01 37.89 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.922 0.489 . . . . 74.34 109.775 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -76.15 -34.6 59.4 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.399 -0.819 . . . . 73.32 111.357 -174.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.648 ' HG3' ' HB2' ' A' ' 113' ' ' GLU . 30.8 tt0 -59.31 -55.34 36.09 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.92 0.488 . . . . 70.34 109.997 175.877 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.556 ' HB2' HG21 ' A' ' 17' ' ' ILE . 80.9 mt -73.43 -16.95 61.3 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.299 -0.864 . . . . 71.31 111.119 -175.266 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.35 -46.3 70.51 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.347 0.659 . . . . 72.04 110.407 171.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.477 ' HB2' ' HG3' ' A' ' 113' ' ' GLU . 18.8 m-85 -73.79 -19.22 60.83 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 115.963 -0.562 . . . . 74.23 110.155 173.678 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.57 44.4 26.7 Favored Glycine 0 C--N 1.35 1.358 0 N-CA-C 111.584 -0.607 . . . . 74.34 111.584 -179.084 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.648 ' HB2' ' HG3' ' A' ' 108' ' ' GLN . 44.0 mt-10 -88.69 174.9 7.76 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.747 0.819 . . . . 55.32 111.25 -177.667 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -109.85 128.21 55.19 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 124.685 1.194 . . . . 73.41 108.928 -178.321 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.404 HG12 ' HB3' ' A' ' 40' ' ' LEU . 5.1 p -75.93 -53.69 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 N-CA-C 107.591 -1.262 . . . . 72.45 107.591 165.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.518 HD11 HD11 ' A' ' 50' ' ' ILE . 30.7 mm -125.37 120.76 58.82 Favored 'Isoleucine or valine' 0 C--N 1.346 0.45 0 N-CA-C 106.207 -1.775 . . . . 61.35 106.207 167.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t -80.65 -177.86 6.48 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.033 0.933 . . . . 72.4 111.04 -175.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.7 15.49 3.18 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 124.766 1.226 . . . . 72.31 111.245 171.612 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 . . . . . 0 CA--C 1.556 1.176 0 C-N-CA 124.321 1.049 . . . . 74.04 109.842 177.803 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 109.12 -0.696 . . . . 75.35 109.12 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 136.59 121.98 2.11 Favored Glycine 0 C--N 1.349 1.261 0 O-C-N 123.514 0.509 . . . . 72.24 112.223 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -158.56 103.16 1.74 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.649 0.78 . . . . 75.01 109.943 175.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 26.0 t60 -144.17 93.65 2.47 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 108.742 -0.836 . . . . 64.13 108.742 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 -122.93 108.68 13.22 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.78 0.832 . . . . 72.43 109.248 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.8 m-70 -136.08 62.87 1.61 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.953 0.901 . . . . 65.41 109.3 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -95.45 135.67 36.8 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.197 -0.911 . . . . 71.01 109.501 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -128.93 137.21 51.27 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.399 0.679 . . . . 71.33 109.831 -178.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.4 t -167.09 123.45 1.16 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.958 0.503 . . . . 71.33 110.191 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -156.78 136.71 12.58 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.667 0.787 . . . . 72.54 109.73 174.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.0 ttp -153.55 98.26 2.21 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 108.598 -0.889 . . . . 74.32 108.598 177.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -151.22 117.26 5.56 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.277 0.631 . . . . 62.1 109.421 -175.029 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.1 m -139.44 92.94 2.62 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.46 0.704 . . . . 73.33 109.598 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -88.94 119.86 29.84 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.564 0.745 . . . . 72.51 109.972 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.497 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 2.2 mmp_? -103.56 119.81 39.62 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.804 0.841 . . . . 74.12 109.175 173.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.446 HD22 ' H ' ' A' ' 16' ' ' LEU . 2.3 pt? -121.82 126.2 48.23 Favored 'General case' 0 C--O 1.243 0.712 0 N-CA-C 107.646 -1.242 . . . . 74.5 107.646 177.861 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.404 ' O ' HG12 ' A' ' 19' ' ' ILE . 67.6 mt -73.05 135.14 28.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 107.357 -1.349 . . . . 74.51 107.357 172.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -67.51 105.42 1.83 Allowed 'General case' 0 C--O 1.241 0.644 0 CA-C-O 121.494 0.664 . . . . 75.32 110.25 -171.613 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.404 HG12 ' O ' ' A' ' 17' ' ' ILE . 49.8 mm -118.79 109.95 28.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 N-CA-C 106.378 -1.712 . . . . 74.2 106.378 -176.826 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -92.87 119.48 32.23 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 108.678 -0.86 . . . . 74.51 108.678 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.9 t -92.55 118.79 31.37 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.734 -0.839 . . . . 65.04 108.734 -178.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.4 mt -124.58 140.7 52.7 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.331 1.052 . . . . 73.34 109.19 -173.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 17.9 p -82.09 152.96 26.33 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 122.77 0.428 . . . . 70.4 110.595 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.7 p -114.4 169.94 6.01 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.119 0.968 . . . . 75.15 108.645 -178.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -59.63 -12.22 16.92 Favored 'Trans proline' 0 C--N 1.381 2.252 0 C-N-CA 122.487 2.124 . . . . 74.44 113.598 168.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.469 ' HB2' ' HB1' ' A' ' 29' ' ' ALA . 84.0 m-20 -95.0 151.49 19.12 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.203 1.001 . . . . 71.41 110.701 176.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -82.86 -45.26 14.46 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.265 0.626 . . . . 71.14 109.966 174.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -92.52 29.95 1.62 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.067 0.947 . . . . 72.11 111.048 -174.808 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.469 ' HB1' ' HB2' ' A' ' 26' ' ' ASN . . . -139.45 127.6 22.49 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.9 0.88 . . . . 74.53 108.769 171.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.9 tp -129.1 125.64 37.61 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.869 -1.159 . . . . 71.22 107.869 174.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -82.62 133.05 35.18 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.094 0.958 . . . . 73.51 110.588 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -117.01 122.96 45.71 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 107.885 -1.154 . . . . 73.21 107.885 171.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.7 tp -118.31 130.56 56.1 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.422 0.689 . . . . 73.0 111.099 -169.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 p -90.11 120.95 31.73 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 108.538 -0.912 . . . . 73.24 108.538 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 60.0 p -108.9 -26.95 9.97 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 113.669 0.988 . . . . 75.21 113.669 -164.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -72.32 -37.65 68.86 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 118.113 0.415 . . . . 74.41 110.599 -175.045 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 157.18 1.24 0.1 OUTLIER Glycine 0 C--N 1.345 1.037 0 CA-C-O 119.514 -0.604 . . . . 61.14 114.218 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.5 ' HB3' HD23 ' A' ' 109' ' ' LEU . 18.6 mp0 -79.77 84.84 5.51 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.365 0.666 . . . . 74.3 110.879 -171.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.638 ' HE2' ' HB2' ' A' ' 43' ' ' ARG . 79.7 mtp -77.72 124.81 28.43 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.118 0.485 . . . . 75.01 110.457 -179.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.523 ' HB3' HG12 ' A' ' 115' ' ' VAL . 95.6 mt -65.64 -33.23 75.41 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 125.142 1.377 . . . . 74.13 112.209 -177.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.571 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 29.1 tt0 -147.73 153.75 39.67 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.81 1.244 . . . . 74.11 107.76 -174.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 5.0 t -75.78 129.09 36.49 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.246 0.218 . . . . 72.32 110.55 -174.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.638 ' HB2' ' HE2' ' A' ' 39' ' ' MET . 4.0 tpm_? -51.29 97.83 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.439 1.495 . . . . 75.24 110.988 179.019 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 143.61 -20.77 2.2 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 116.066 -0.515 . . . . 72.53 112.286 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 63.8 m -85.91 125.7 33.53 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.412 0.685 . . . . 63.3 109.157 174.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -62.12 145.88 52.08 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.014 0.526 . . . . 74.33 111.665 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.1 m -63.05 113.09 2.91 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.107 0.963 . . . . 73.21 111.441 -174.248 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.6 mt -80.85 116.1 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 123.607 0.763 . . . . 70.22 110.365 -174.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 64.4 t -91.55 108.26 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 N-CA-C 109.082 -0.71 . . . . 71.1 109.082 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.419 ' HB ' ' HB2' ' A' ' 77' ' ' LEU . 73.3 mt -96.45 110.28 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 108.066 -1.087 . . . . 75.32 108.066 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.419 ' HB2' ' HZ1' ' A' ' 51' ' ' LYS . 10.4 mtmp? -92.52 161.66 14.53 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.869 0.467 . . . . 74.05 110.279 -179.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.9 p30 -65.58 -25.82 67.57 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 113.736 1.013 . . . . 74.11 113.736 -175.059 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.0 p -84.9 -12.1 54.15 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.384 0.274 . . . . 64.23 111.462 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -82.89 68.97 9.59 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.32 0.648 . . . . 73.45 110.043 -177.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -49.26 -39.33 30.09 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.504 1.522 . . . . 71.22 111.648 176.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 39.6 t-20 -60.23 -50.13 74.89 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.568 1.147 . . . . 71.32 110.568 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 71.2 mt -74.73 -28.93 60.99 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.855 0.462 . . . . 70.34 111.559 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 82.8 mt -67.14 -49.2 75.19 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 N-CA-C 109.224 -0.658 . . . . 62.32 109.224 174.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -66.54 -24.42 66.37 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.121 0.415 . . . . 74.42 112.121 177.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -79.77 -24.74 41.31 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 112.022 0.379 . . . . 64.2 112.022 175.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.9 t -114.97 108.52 16.81 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 109.747 -0.464 . . . . 73.43 109.747 177.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -64.54 -31.64 72.94 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.057 0.543 . . . . 63.15 110.778 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.518 ' HB2' ' NE2' ' A' ' 108' ' ' GLN . 58.6 tp -60.74 -41.63 95.77 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.517 0.727 . . . . 72.13 110.599 173.578 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -57.65 -47.39 82.4 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.837 0.455 . . . . 71.44 110.459 177.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -59.17 -44.77 92.16 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.077 -0.965 . . . . 73.35 110.571 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -59.75 -53.33 59.22 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.811 0.844 . . . . 74.33 112.488 177.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.568 HG23 HG21 ' A' ' 74' ' ' VAL . 59.6 mt -65.51 -39.82 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 123.084 0.554 . . . . 74.31 111.143 -174.645 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -66.78 -31.03 71.4 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.337 0.655 . . . . 74.14 111.51 174.367 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.3 tp -70.85 -52.78 18.22 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.872 0.469 . . . . 75.51 110.744 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -69.79 -29.23 66.49 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.321 -0.854 . . . . 74.21 110.894 -174.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.619 ' SG ' HG23 ' A' ' 97' ' ' ILE . 82.3 m -144.61 96.33 5.2 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 108.884 -0.784 . . . . 71.03 108.884 176.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -63.87 -4.57 7.54 Favored 'Trans proline' 0 N--CA 1.5 1.911 0 C-N-CA 123.276 2.651 . . . . 73.24 114.315 175.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.487 ' HA3' HG22 ' A' ' 92' ' ' VAL . . . -86.99 8.64 75.56 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-O 119.555 -0.581 . . . . 70.23 113.794 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.568 HG21 HG23 ' A' ' 67' ' ' ILE . 99.9 t -69.79 124.74 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.192 0.597 . . . . 64.31 110.073 173.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.05 -56.6 3.39 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.905 -0.776 . . . . 72.5 108.905 -179.086 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 61.1 m -147.74 167.92 23.43 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 115.768 -0.651 . . . . 61.32 110.891 -178.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.419 ' HB2' ' HB ' ' A' ' 50' ' ' ILE . 77.3 mt -127.16 148.54 50.17 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.535 1.134 . . . . 75.01 109.097 176.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.529 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.0 ttm -126.17 111.02 14.13 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 108.051 -1.092 . . . . 70.02 108.051 169.094 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.0 mm -89.35 103.01 13.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 108.37 -0.974 . . . . 74.45 108.37 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.9 176.81 41.22 Favored Glycine 0 C--O 1.243 0.671 0 N-CA-C 111.5 -0.64 . . . . 75.14 111.5 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.571 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 3.9 m-20 -69.96 -60.28 2.4 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.737 0.779 . . . . 63.23 109.611 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.23 -17.28 14.52 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.82 -1.082 . . . . 73.45 110.302 -177.648 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -118.63 167.99 11.12 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.363 0.665 . . . . 73.03 111.556 -171.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 31.8 tp -141.3 142.59 33.85 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.512 0.725 . . . . 75.44 109.326 175.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.529 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 86.8 m -131.03 118.15 20.17 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.289 0.636 . . . . 73.22 109.685 174.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.501 HG21 ' HZ2' ' A' ' 88' ' ' LYS . 19.7 mm -108.77 108.17 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 109.922 -0.399 . . . . 63.25 109.922 -177.297 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -83.15 146.62 28.54 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.382 0.673 . . . . 71.21 110.53 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.744 ' HE2' HG22 ' A' ' 97' ' ' ILE . 34.6 mmtm -123.51 171.59 9.39 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.893 0.877 . . . . 72.01 110.322 173.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.65 149.13 32.94 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.891 -1.151 . . . . 75.44 107.891 163.301 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -62.79 -24.44 67.74 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.432 0.693 . . . . 74.04 112.599 -175.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 21.5 ptm -73.13 -18.79 61.25 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.059 0.544 . . . . 72.52 111.822 -177.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.487 HG22 ' HA3' ' A' ' 73' ' ' GLY . 8.5 t -100.98 137.14 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.64 0.776 . . . . 71.43 109.811 -175.085 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -97.76 148.52 23.28 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.541 0.736 . . . . 73.14 111.733 -174.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -74.41 -36.43 63.47 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.941 1.296 . . . . 75.53 113.306 -173.693 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -52.57 -29.04 23.58 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.333 1.053 . . . . 63.45 113.241 -173.325 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.7 p -83.07 -36.51 24.84 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.399 0.68 . . . . 74.33 110.676 -178.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.744 HG22 ' HE2' ' A' ' 88' ' ' LYS . 48.2 mt -89.6 -29.53 5.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 CA-C-N 115.118 -0.946 . . . . 73.43 112.196 -164.198 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -53.3 -53.43 56.23 Favored Pre-proline 0 CA--C 1.562 1.426 0 CA-C-O 117.766 -1.111 . . . . 75.31 112.546 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.87 -31.94 94.56 Favored 'Trans proline' 0 C--N 1.395 3.015 0 C-N-CA 121.927 1.752 . . . . 72.45 112.51 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -64.01 -52.75 58.06 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.37 0.419 . . . . 71.44 111.272 177.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 67.5 mt -66.58 -43.7 90.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 122.989 0.515 . . . . 73.45 110.828 -176.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 93.5 mt -58.54 -40.41 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 122.89 0.476 . . . . 71.01 110.49 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.17 -46.99 75.45 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 123.326 0.391 . . . . 71.43 111.046 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.1 mt -62.31 -34.88 77.46 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.526 0.73 . . . . 75.35 111.469 -179.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.66 -35.43 70.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.46 0.704 . . . . 72.31 110.555 175.622 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 92.3 m -72.9 -32.75 65.57 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.638 -0.504 . . . . 74.24 109.638 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -66.7 -57.2 7.62 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.573 0.749 . . . . 75.2 110.129 174.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.518 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 26.2 tt0 -53.28 -55.58 23.5 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.062 0.945 . . . . 75.42 111.637 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.5 HD23 ' HB3' ' A' ' 38' ' ' GLU . 76.8 mt -68.87 -15.85 63.61 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 124.162 0.914 . . . . 74.35 111.609 -174.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -80.34 -20.44 44.19 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.292 0.637 . . . . 54.22 111.628 175.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -100.93 -28.19 12.89 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.217 0.607 . . . . 74.02 110.664 175.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.14 140.96 3.66 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.898 -0.592 . . . . 72.11 111.805 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -59.69 -33.83 72.1 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.898 0.879 . . . . 75.13 111.857 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -75.77 133.52 40.68 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.344 0.592 . . . . 74.54 111.822 -173.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.523 HG12 ' HB3' ' A' ' 40' ' ' LEU . 3.1 p -87.0 -44.53 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 107.889 -1.152 . . . . 63.55 107.889 158.078 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 66.3 mt -134.23 120.26 33.66 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 124.914 1.286 . . . . 70.3 107.691 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.8 m -83.04 69.15 9.78 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 108.465 -0.939 . . . . 62.14 108.465 173.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -84.04 93.28 8.06 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.302 -0.863 . . . . 74.55 110.262 -177.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 . . . . . 0 C--O 1.25 1.101 0 N-CA-C 106.545 -1.65 . . . . 63.2 106.545 173.583 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.522 0.201 . . . . 72.53 110.575 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.95 39.04 0.03 OUTLIER Glycine 0 C--N 1.347 1.142 0 N-CA-C 112.148 -0.381 . . . . 64.12 112.148 178.806 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -94.3 63.7 3.09 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.81 0.814 . . . . 71.34 109.357 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -85.32 105.3 15.88 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 114.878 -1.055 . . . . 72.34 111.113 -173.492 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.2 p-80 -154.71 112.89 3.5 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.227 0.611 . . . . 71.13 110.372 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -162.13 108.93 1.32 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.169 0.988 . . . . 74.54 109.032 174.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 12.4 p80 -163.75 73.77 0.3 Allowed 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.348 0.659 . . . . 75.05 111.078 -177.384 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.7 p-80 -163.68 20.31 0.07 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.193 0.597 . . . . 75.45 112.423 176.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.2 p -90.34 113.39 25.25 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.706 0.403 . . . . 74.4 110.202 176.171 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 -119.61 141.62 49.14 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.705 0.802 . . . . 73.32 109.716 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -140.67 103.78 4.59 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.312 0.577 . . . . 63.21 110.716 -176.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -126.25 116.52 21.4 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.12 0.968 . . . . 73.32 108.963 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.6 t -137.51 92.27 2.68 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 109.094 -0.706 . . . . 73.21 109.094 177.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -90.54 156.37 18.21 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.593 0.757 . . . . 74.11 110.072 177.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.427 HH22 ' HB2' ' A' ' 36' ' ' ASP . 2.4 ptm180 -139.2 168.26 20.22 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.59 0.756 . . . . 74.51 110.54 177.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.4 mt -122.87 175.65 6.43 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.541 0.737 . . . . 74.21 110.118 170.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.518 ' HB ' HG21 ' A' ' 106' ' ' THR . 93.0 mt -123.18 105.04 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.097 0.959 . . . . 74.43 109.745 -176.324 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -84.67 135.46 34.15 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.1 0.56 . . . . 63.2 110.028 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.537 ' HB ' HG22 ' A' ' 102' ' ' ILE . 47.7 mm -128.78 122.23 56.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 107.522 -1.288 . . . . 73.21 107.522 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -101.6 125.44 48.26 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.288 1.035 . . . . 74.14 108.629 -176.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' THR . . . . . 0.5 HG22 ' HE3' ' A' ' 98' ' ' LYS . 28.8 m -105.53 111.22 23.84 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.594 -0.891 . . . . 64.43 108.594 -179.189 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.0 mt -100.43 139.35 36.23 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.966 0.906 . . . . 75.0 111.112 -174.514 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.2 p -70.48 130.4 41.77 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 124.372 1.045 . . . . 73.43 110.165 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 43.5 p -118.21 152.76 51.03 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 123.177 0.591 . . . . 73.01 110.185 -174.62 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.86 8.33 3.49 Favored 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 122.911 2.407 . . . . 74.24 112.615 172.299 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -90.42 123.57 34.25 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.333 1.053 . . . . 73.42 109.073 -178.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . 0.463 ' HG2' HD21 ' A' ' 28' ' ' ASN . 45.5 tt0 -77.87 130.77 37.04 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.399 0.68 . . . . 74.24 110.731 -177.621 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.463 HD21 ' HG2' ' A' ' 27' ' ' GLU . 51.2 m-80 59.1 25.11 13.51 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.637 1.175 . . . . 75.31 112.263 -173.718 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.501 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -142.02 139.48 32.37 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.382 0.673 . . . . 72.11 109.686 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.4 tp -148.34 138.04 22.25 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.733 0.413 . . . . 73.53 110.555 -173.324 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -85.9 123.78 31.63 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.374 0.669 . . . . 75.44 111.814 -174.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -110.34 110.6 21.45 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 107.174 -1.417 . . . . 70.3 107.174 170.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.3 tp -106.08 129.62 54.14 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.331 1.052 . . . . 72.33 110.24 -167.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.9 m -77.51 104.99 8.36 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.995 -0.743 . . . . 72.12 108.995 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.5 p -113.09 10.56 18.73 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.552 0.741 . . . . 65.42 111.278 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.427 ' HB2' HH22 ' A' ' 15' ' ' ARG . 6.2 p-10 -75.34 -26.7 58.8 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.379 0.672 . . . . 75.44 110.902 -179.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.71 -36.96 1.92 Allowed Glycine 0 C--N 1.334 0.419 0 N-CA-C 110.395 -1.082 . . . . 75.33 110.395 -176.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -78.2 161.41 27.34 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 122.026 0.917 . . . . 74.3 111.446 174.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.435 ' HE3' ' HB3' ' A' ' 82' ' ' ASP . 85.0 mtp -117.97 142.53 47.26 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 106.376 -1.713 . . . . 71.33 106.376 170.634 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 82.5 mt -55.29 -45.22 76.24 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.842 0.457 . . . . 72.43 112.021 -175.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.614 ' NE2' ' HB ' ' A' ' 116' ' ' ILE . 33.2 tt0 -133.74 145.55 49.94 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.333 1.053 . . . . 75.25 108.789 -177.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 9.4 m -64.35 146.57 54.22 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.086 0.554 . . . . 64.34 109.899 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -58.5 -5.04 0.47 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 116.359 1.985 . . . . 71.13 116.359 -161.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -87.2 54.28 4.5 Favored Glycine 0 CA--C 1.533 1.176 0 N-CA-C 111.157 -0.777 . . . . 73.35 111.157 165.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.1 m -97.01 169.1 10.06 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.768 0.827 . . . . 75.4 111.009 -176.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -120.05 178.02 4.77 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 108.115 -1.069 . . . . 74.04 108.115 168.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.1 p -87.87 71.8 9.44 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.603 -1.258 . . . . 64.34 107.603 167.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.559 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 55.9 mt -72.42 104.49 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 115.323 -0.853 . . . . 71.35 109.817 -167.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.424 ' HA ' ' O ' ' A' ' 77' ' ' LEU . 60.2 t -87.63 109.59 19.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.806 -0.813 . . . . 75.54 108.806 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.432 HG22 ' HB2' ' A' ' 57' ' ' LEU . 52.5 mt -109.41 112.37 40.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 108.674 -0.862 . . . . 74.03 108.674 178.522 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.5 mtpt -86.47 162.01 18.31 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 109.39 -0.596 . . . . 75.23 109.39 173.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.8 p-10 -59.06 -24.75 63.15 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.41 1.084 . . . . 72.24 112.332 178.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.1 t -81.63 -18.23 45.39 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.073 0.549 . . . . 65.41 111.196 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.0 68.28 7.23 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.971 0.908 . . . . 73.22 111.115 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -60.02 -27.27 66.76 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.453 0.701 . . . . 73.41 110.994 176.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -60.37 -40.21 90.02 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 122.927 0.491 . . . . 74.32 111.355 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.432 ' HB2' HG22 ' A' ' 50' ' ' ILE . 87.1 mt -81.24 -35.7 30.88 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.808 0.843 . . . . 73.53 111.748 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 83.0 mt -63.22 -35.09 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.771 0.828 . . . . 75.11 109.836 176.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -63.02 -28.1 69.87 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.755 1.222 . . . . 64.21 111.663 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -82.02 -7.35 59.61 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.48 0.712 . . . . 72.31 111.926 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.473 ' HB2' HG12 ' A' ' 116' ' ' ILE . 39.2 t -135.74 101.77 4.87 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.895 0.478 . . . . 73.33 111.013 -171.08 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -54.76 -36.32 64.73 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.241 0.616 . . . . 70.35 110.648 170.7 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.557 ' HB2' ' HG3' ' A' ' 108' ' ' GLN . 27.2 tp -63.61 -44.08 95.0 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.261 0.624 . . . . 73.02 111.155 177.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.03 98.07 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.901 0.48 . . . . 72.32 111.099 179.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -54.43 -48.41 71.69 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 124.144 0.902 . . . . 74.04 110.475 175.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.512 ' HB3' HD23 ' A' ' 104' ' ' LEU . 27.9 mm-40 -63.68 -41.08 98.2 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.167 0.987 . . . . 75.45 113.101 178.405 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.508 HG21 HD21 ' A' ' 77' ' ' LEU . 95.9 mt -64.68 -53.22 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.472 0.709 . . . . 72.34 111.164 -178.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -68.49 -27.75 66.4 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 123.415 0.447 . . . . 73.04 111.416 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -66.55 -58.58 4.9 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.182 0.593 . . . . 73.45 110.739 177.008 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.46 ' NE2' HD21 ' A' ' 104' ' ' LEU . 78.7 mt-30 -79.21 -26.59 42.55 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.765 -0.652 . . . . 74.34 112.139 -174.057 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 79.5 m -133.08 86.85 41.29 Favored Pre-proline 0 CA--C 1.548 0.891 0 N-CA-C 108.904 -0.776 . . . . 72.23 108.904 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.88 -7.08 19.56 Favored 'Trans proline' 0 C--N 1.369 1.641 0 C-N-CA 122.933 2.422 . . . . 72.33 112.644 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.23 -15.28 81.71 Favored Glycine 0 C--N 1.347 1.19 0 CA-C-N 116.221 -0.445 . . . . 65.14 113.138 178.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 68.0 t -73.39 121.8 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 108.683 -0.858 . . . . 73.13 108.683 174.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -90.95 -28.67 17.9 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 115.9 -0.591 . . . . 74.14 110.904 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.7 t -161.65 161.63 29.63 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.591 0.71 . . . . 73.04 111.536 -171.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.508 HD21 HG21 ' A' ' 67' ' ' ILE . 84.6 mt -126.06 150.94 47.78 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.734 1.214 . . . . 75.1 108.228 177.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.557 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.3 ttm -125.01 104.15 8.4 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.028 -1.471 . . . . 73.21 107.028 168.084 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.697 HD13 HD12 ' A' ' 84' ' ' LEU . 34.2 mm -86.82 132.76 31.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.524 -0.917 . . . . 75.32 108.524 -175.436 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -121.14 -170.58 14.05 Favored Glycine 0 C--O 1.245 0.834 0 N-CA-C 110.901 -0.88 . . . . 74.43 110.901 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.02 -55.06 16.05 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.04 0.924 . . . . 74.53 109.707 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.435 ' HB3' ' HE3' ' A' ' 39' ' ' MET . 2.8 p-10 -118.03 0.98 11.96 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.513 -1.221 . . . . 74.41 111.705 -172.066 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -140.52 166.26 25.21 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.351 0.596 . . . . 73.44 111.661 -170.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.697 HD12 HD13 ' A' ' 79' ' ' ILE . 17.3 tp -141.65 116.56 9.86 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 114.368 -1.287 . . . . 72.11 108.601 176.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 14.1 m -100.61 111.56 23.82 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.261 -1.015 . . . . 74.01 108.261 179.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.501 ' O ' ' HA ' ' A' ' 29' ' ' ALA . 43.2 mm -86.31 125.88 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 109.244 -0.65 . . . . 73.52 109.244 -174.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -110.57 118.7 36.94 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 107.976 -1.12 . . . . 72.35 107.976 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -130.37 170.86 13.6 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 120.953 0.406 . . . . 74.31 111.205 -174.075 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.404 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 16.6 t70 -71.7 148.99 45.89 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 115.092 -0.958 . . . . 74.33 110.638 174.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 18.1 ptp180 -62.69 -24.11 67.48 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.309 1.044 . . . . 74.02 113.03 -175.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 86.8 mtp -80.11 -14.75 58.26 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.847 0.459 . . . . 74.1 111.784 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.84 124.09 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.543 0.737 . . . . 73.43 109.262 -175.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -89.18 142.47 27.62 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.489 0.716 . . . . 72.34 110.749 -172.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -58.81 -33.75 70.73 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.832 0.853 . . . . 75.51 112.442 178.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -61.62 -23.59 66.14 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.206 0.602 . . . . 75.25 112.277 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 26.5 m -91.61 -17.89 24.86 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.463 0.705 . . . . 74.25 111.849 177.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 87.1 mt -96.29 -50.8 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.894 0.878 . . . . 74.23 111.198 -171.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.5 ' HE3' HG22 ' A' ' 21' ' ' THR . 57.7 mtpt -56.15 -57.51 22.0 Favored Pre-proline 0 CA--C 1.551 0.988 0 CA-C-O 117.436 -1.269 . . . . 74.33 113.565 -167.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -59.59 -36.51 92.4 Favored 'Trans proline' 0 C--N 1.395 2.999 0 C-N-CA 121.978 1.786 . . . . 71.32 111.842 -174.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.471 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 6.3 mm-40 -66.59 -49.83 65.05 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 114.917 -1.038 . . . . 75.52 110.928 -177.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 24.4 mt -75.48 -29.88 21.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 C-N-CA 123.209 0.604 . . . . 70.23 111.502 -175.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.537 HG22 ' HB ' ' A' ' 19' ' ' ILE . 93.7 mt -60.2 -42.54 90.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-O 121.108 0.48 . . . . 74.32 109.795 170.442 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -63.63 -40.06 95.92 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 114.926 -1.034 . . . . 74.54 110.852 176.39 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.512 HD23 ' HB3' ' A' ' 66' ' ' GLN . 98.5 mt -66.57 -38.37 86.91 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.622 0.769 . . . . 73.23 112.53 178.961 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.608 HD13 HD21 ' A' ' 84' ' ' LEU . 10.0 mp -65.38 -24.24 67.17 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.621 0.369 . . . . 73.11 110.802 174.575 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.518 HG21 ' HB ' ' A' ' 17' ' ' ILE . 89.2 m -81.69 -37.16 27.82 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.569 0.747 . . . . 72.05 109.612 177.258 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -63.21 -46.62 86.17 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.436 0.695 . . . . 73.05 111.138 175.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.557 ' HG3' ' HB2' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -64.09 -56.97 11.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.002 0.921 . . . . 71.25 110.3 -175.027 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.473 ' HB2' HD12 ' A' ' 17' ' ' ILE . 97.1 mt -68.54 -12.63 61.54 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 115.761 -0.654 . . . . 73.22 112.279 -176.292 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -88.06 -49.54 6.97 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.863 0.465 . . . . 74.44 111.268 174.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -92.49 -16.53 25.68 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.649 0.379 . . . . 75.13 111.855 -170.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -134.13 -135.66 3.57 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 110.893 -0.883 . . . . 63.24 110.893 -178.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -160.85 -60.18 0.06 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.613 0.765 . . . . 72.42 110.071 -175.594 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -92.44 141.9 28.02 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.738 0.815 . . . . 43.43 110.087 -178.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.47 HG22 HD11 ' A' ' 79' ' ' ILE . 6.0 p -71.44 -43.27 72.81 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 N-CA-C 108.573 -0.899 . . . . 64.14 108.573 168.109 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.614 ' HB ' ' NE2' ' A' ' 41' ' ' GLN . 83.3 mt -139.66 134.07 38.11 Favored 'Isoleucine or valine' 0 C--O 1.243 0.748 0 C-N-CA 124.957 1.303 . . . . 74.11 107.757 178.221 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 12.8 p -74.34 82.59 1.9 Allowed 'General case' 0 CA--C 1.549 0.929 0 CA-C-O 121.509 0.671 . . . . 74.42 109.395 171.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -81.17 77.65 8.04 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 107.772 -1.195 . . . . 75.4 107.772 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 . . . . . 0 C--O 1.246 0.903 0 N-CA-C 108.126 -1.065 . . . . 65.22 108.126 -170.547 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 109.978 -0.378 . . . . 74.33 109.978 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 155.9 109.53 0.31 Allowed Glycine 0 C--N 1.35 1.331 0 CA-C-O 119.863 -0.41 . . . . 74.02 112.875 177.244 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 67.1 m170 -121.38 112.17 18.22 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.008 0.923 . . . . 75.41 109.379 172.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 52.5 p-80 -170.75 144.11 2.23 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.088 0.955 . . . . 72.12 109.452 170.653 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -124.77 -172.68 2.62 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.618 0.767 . . . . 72.42 109.529 177.23 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 53.9 m80 -133.94 140.43 46.76 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.85 0.86 . . . . 74.41 109.219 177.729 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.5 m80 -88.38 121.09 30.38 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.675 0.79 . . . . 74.35 110.42 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 47.1 p-80 -91.47 130.21 37.34 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 109.006 -0.739 . . . . 73.44 109.006 172.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.3 p -150.23 113.52 4.9 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.657 0.783 . . . . 72.42 110.073 -176.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.08 147.1 25.46 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.264 0.626 . . . . 71.55 109.868 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 23.2 ptm -147.34 126.77 13.17 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 107.879 -1.156 . . . . 72.52 107.879 175.379 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -61.3 103.46 0.3 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.147 0.579 . . . . 64.45 109.605 -176.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.7 p -129.49 45.64 2.77 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.938 0.895 . . . . 63.44 111.218 -168.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -71.44 91.94 1.06 Allowed 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 109.376 -0.602 . . . . 74.34 109.376 173.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -73.8 152.95 40.15 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.88 0.872 . . . . 75.23 110.302 -177.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -126.65 169.34 13.22 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.197 0.599 . . . . 74.42 110.524 -179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 11.6 mm -79.58 123.18 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.024 0.93 . . . . 74.33 110.557 -166.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . 0.483 ' HB2' ' O ' ' A' ' 35' ' ' THR . 5.0 m170 -87.89 138.05 31.79 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 107.728 -1.212 . . . . 73.14 107.728 174.238 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.514 ' HB ' HG22 ' A' ' 102' ' ' ILE . 51.4 mm -123.06 116.45 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 107.848 -1.168 . . . . 62.5 107.848 -176.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.556 ' HE3' HD22 ' A' ' 22' ' ' LEU . 62.6 tttp -100.12 125.77 46.27 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.167 1.387 . . . . 75.23 108.955 -172.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 89.5 m -93.77 112.01 23.8 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.679 -0.86 . . . . 63.52 108.679 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.556 HD22 ' HE3' ' A' ' 20' ' ' LYS . 93.9 mt -106.31 136.59 45.77 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 123.737 0.815 . . . . 75.24 109.49 177.953 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 34.6 p -89.16 143.25 26.98 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.635 0.774 . . . . 71.42 110.405 179.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.7 p -119.98 154.24 55.42 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 124.377 1.071 . . . . 74.23 109.278 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -49.7 -45.97 29.27 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 123.571 2.847 . . . . 74.11 113.244 176.069 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -77.85 114.99 17.25 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.818 0.847 . . . . 71.25 109.145 175.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.38 -19.35 59.6 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.864 0.466 . . . . 63.43 111.436 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -63.42 -27.18 69.12 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.914 0.886 . . . . 74.44 109.612 172.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -102.37 154.06 19.43 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.056 1.342 . . . . 75.42 110.94 176.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 tp -151.07 127.82 10.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.683 0.793 . . . . 73.12 108.884 170.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -90.17 138.19 31.73 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.326 0.65 . . . . 74.24 111.729 -174.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -123.49 126.25 46.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.699 1.2 . . . . 74.13 108.638 171.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.6 tp -117.05 125.72 51.76 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.269 1.027 . . . . 73.41 108.656 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.4 p -80.59 107.07 13.09 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 108.848 -0.797 . . . . 71.12 108.848 176.448 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.483 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 26.0 p -106.87 127.43 53.41 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.009 1.324 . . . . 71.52 108.638 -177.894 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 57.99 73.79 0.45 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.349 1.06 . . . . 75.43 109.943 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -175.82 -130.05 1.28 Allowed Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 114.277 -1.328 . . . . 43.41 110.474 -176.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -129.4 156.26 44.36 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.818 0.847 . . . . 73.2 109.753 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 15.7 ttt -78.4 144.99 35.4 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.489 0.716 . . . . 64.21 110.776 -171.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.469 HD11 ' HB2' ' A' ' 84' ' ' LEU . 96.3 mt -70.73 -39.27 73.47 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.52 0.728 . . . . 73.2 112.2 -175.345 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.55 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.9 tp-100 -147.83 149.94 33.25 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.949 0.899 . . . . 74.54 109.031 -176.254 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 47.5 m -73.14 140.73 47.28 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.036 0.535 . . . . 74.34 110.154 176.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -63.66 -22.03 66.69 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.879 0.872 . . . . 74.42 112.266 -175.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -64.61 -23.43 68.79 Favored Glycine 0 C--N 1.35 1.326 0 CA-C-O 120.046 -0.308 . . . . 74.35 113.713 176.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.7 m -90.15 166.68 13.25 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.785 0.834 . . . . 63.25 111.678 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -94.99 -172.95 2.83 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.217 1.007 . . . . 75.03 109.881 175.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.6 p -72.56 101.26 2.95 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.542 0.737 . . . . 73.34 110.189 174.316 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 53.9 mt -78.51 102.53 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.445 0.698 . . . . 73.53 109.72 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 40.5 t -90.19 108.71 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 N-CA-C 109.036 -0.728 . . . . 54.45 109.036 -176.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 72.2 mt -98.36 109.14 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 N-CA-C 108.593 -0.891 . . . . 74.45 108.593 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -103.55 141.01 36.75 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.0 0.52 . . . . 75.2 110.007 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -62.37 -23.84 67.03 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.846 0.858 . . . . 54.44 112.842 -175.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.3 t -69.6 -35.62 75.48 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.35 0.66 . . . . 74.25 110.763 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -97.13 77.24 2.7 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 107.755 -1.202 . . . . 75.21 107.755 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.525 ' HA ' HD11 ' A' ' 58' ' ' ILE . 36.8 tt0 -66.34 -15.68 63.46 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.486 -0.779 . . . . 74.44 112.138 -172.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -63.35 -38.02 89.52 Favored 'General case' 0 C--N 1.35 0.623 0 N-CA-C 110.09 -0.337 . . . . 71.55 110.09 173.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.09 -36.43 84.27 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.593 0.757 . . . . 70.33 110.419 177.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.525 HD11 ' HA ' ' A' ' 55' ' ' GLU . 1.9 mp -61.73 -50.1 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 CA-C-N 115.063 -0.972 . . . . 63.11 109.026 173.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -65.87 -24.62 66.9 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.596 0.758 . . . . 64.14 112.016 -176.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 29.1 m170 -72.94 -39.07 66.54 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.795 0.438 . . . . 74.32 110.251 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.549 ' HA ' ' HA ' ' A' ' 116' ' ' ILE . 34.5 m -106.93 112.86 26.02 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.499 0.72 . . . . 74.24 111.614 -172.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -55.98 -39.09 71.3 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.201 0.6 . . . . 72.52 111.268 177.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.61 HD11 HD13 ' A' ' 105' ' ' LEU . 21.4 tp -61.62 -40.04 93.44 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 123.718 0.637 . . . . 70.12 111.065 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.422 ' HA ' HD13 ' A' ' 77' ' ' LEU . . . -65.94 -42.97 89.33 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.071 0.548 . . . . 74.03 111.003 179.446 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -55.89 -50.69 69.97 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.259 0.624 . . . . 75.44 109.947 176.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.498 ' HB3' HD23 ' A' ' 104' ' ' LEU . 26.7 mm-40 -59.31 -50.66 73.15 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.441 1.096 . . . . 73.43 112.613 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.0 mt -66.85 -51.28 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.354 0.662 . . . . 72.14 111.475 -174.109 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -67.18 -29.99 69.83 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.038 0.535 . . . . 74.52 111.827 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -70.07 -59.53 2.84 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-O 120.883 0.373 . . . . 72.23 110.814 176.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -82.75 -10.51 58.86 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.578 0.751 . . . . 74.41 111.984 -170.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.473 ' SG ' HG12 ' A' ' 97' ' ' ILE . 44.4 t -145.49 84.08 8.64 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 108.696 -0.853 . . . . 73.05 108.696 169.393 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -69.91 2.64 3.44 Favored 'Trans proline' 0 C--N 1.381 2.278 0 C-N-CA 123.195 2.597 . . . . 60.45 113.817 179.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . 0.49 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -84.39 -1.44 89.35 Favored Glycine 0 C--N 1.349 1.259 0 N-CA-C 114.168 0.427 . . . . 73.32 114.168 176.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.461 HG23 ' HG ' ' A' ' 71' ' ' CYS . 89.3 t -85.45 132.07 32.74 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 123.211 0.604 . . . . 72.14 109.443 174.389 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -84.01 -50.31 8.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.561 1.144 . . . . 75.15 110.875 176.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.8 p -155.02 155.5 34.27 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.61 -0.723 . . . . 73.12 110.955 -174.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 64' ' ' ALA . 36.3 mt -106.85 148.58 28.37 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.378 -1.341 . . . . 74.12 107.378 170.556 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.549 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 50.6 ttm -125.32 101.08 6.8 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 106.6 -1.63 . . . . 74.34 106.6 167.287 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.761 HG23 HG13 ' A' ' 115' ' ' VAL . 18.2 mm -81.01 107.44 13.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 107.921 -1.14 . . . . 74.32 107.921 -178.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.53 170.38 36.88 Favored Glycine 0 C--O 1.245 0.805 0 N-CA-C 109.689 -1.364 . . . . 61.42 109.689 171.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.55 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 6.9 p-10 -59.64 -51.41 69.94 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 123.854 0.384 . . . . 73.44 110.588 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -107.2 -30.46 8.74 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.01 0.524 . . . . 64.24 111.121 177.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -99.2 161.22 13.74 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.2 0.6 . . . . 75.12 111.876 -172.663 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.469 ' HB2' HD11 ' A' ' 40' ' ' LEU . 26.3 tp -134.24 112.04 10.74 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.747 0.819 . . . . 74.21 108.99 172.341 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.549 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 25.5 m -100.79 105.52 16.83 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.868 -0.79 . . . . 72.53 108.868 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 33.4 mm -88.26 124.97 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 108.787 -0.819 . . . . 74.22 108.787 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -110.31 123.77 50.44 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.193 -1.04 . . . . 72.41 108.193 177.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.454 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -117.52 178.33 4.43 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.051 0.54 . . . . 75.45 110.67 -173.199 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 23.2 t70 -92.33 155.41 17.94 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.536 0.734 . . . . 72.3 110.432 173.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -58.26 -35.43 71.74 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.603 1.161 . . . . 71.22 113.635 -173.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 79.3 mtp -76.69 -21.38 55.45 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.847 0.459 . . . . 71.33 111.85 -175.641 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.49 HG11 ' HA3' ' A' ' 73' ' ' GLY . 10.9 t -103.21 121.08 54.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 108.824 -0.806 . . . . 74.44 108.824 -173.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -101.61 150.88 22.64 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.042 0.937 . . . . 75.15 109.271 -171.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.454 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 85.6 m95 -59.52 -15.71 19.77 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.893 1.071 . . . . 75.5 113.893 -172.386 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -58.61 -39.24 79.88 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.698 0.799 . . . . 72.33 111.692 176.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.3 t -91.29 -12.99 33.48 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.666 0.787 . . . . 74.42 111.32 -176.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.473 HG12 ' SG ' ' A' ' 71' ' ' CYS . 59.6 mt -103.27 -54.79 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 C-N-CA 123.769 0.828 . . . . 74.02 111.253 -168.501 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -54.34 -54.19 50.96 Favored Pre-proline 0 CA--C 1.566 1.596 0 C-N-CA 124.78 1.232 . . . . 63.33 113.494 -171.35 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.29 -36.12 80.98 Favored 'Trans proline' 0 C--N 1.401 3.318 0 C-N-CA 122.237 1.958 . . . . 75.23 112.237 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.46 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 15.6 mm-40 -62.65 -48.66 78.38 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.579 -0.737 . . . . 72.24 110.085 178.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 50.9 mt -67.29 -41.79 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 123.395 0.678 . . . . 73.44 111.755 -177.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.514 HG22 ' HB ' ' A' ' 19' ' ' ILE . 57.9 mt -56.82 -41.25 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 123.112 0.565 . . . . 73.12 110.854 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -57.18 -52.13 66.54 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.46 0.704 . . . . 73.45 110.609 174.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.498 HD23 ' HB3' ' A' ' 66' ' ' GLN . 61.8 mt -64.04 -36.13 82.98 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.353 1.061 . . . . 62.32 112.316 -174.572 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.61 HD13 HD11 ' A' ' 63' ' ' LEU . 9.2 mp -69.88 -29.48 66.7 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.642 0.777 . . . . 64.24 111.028 177.814 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 50.3 m -78.14 -41.51 34.72 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.953 -0.758 . . . . 73.25 108.953 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -58.32 -56.86 16.57 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.337 1.055 . . . . 73.32 111.218 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.489 ' OE1' ' HB2' ' A' ' 63' ' ' LEU . 28.9 tt0 -58.04 -50.32 73.83 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.72 0.808 . . . . 75.03 111.585 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 82.4 mt -77.58 -18.07 57.23 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 115.049 -0.978 . . . . 64.12 111.639 -175.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.36 -42.57 71.64 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 122.746 0.419 . . . . 73.22 110.401 173.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -72.9 -19.33 61.29 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.858 -0.61 . . . . 74.32 110.361 172.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.81 59.58 2.77 Favored Glycine 0 C--N 1.344 1.022 0 CA-C-N 115.729 -0.669 . . . . 53.21 112.413 173.328 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -137.12 157.27 47.07 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 123.12 0.568 . . . . 73.2 110.119 177.704 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -80.68 160.46 24.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.803 1.241 . . . . 73.43 110.177 177.447 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.761 HG13 HG23 ' A' ' 79' ' ' ILE . 2.1 p -50.5 -50.31 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 124.521 1.129 . . . . 75.34 112.478 178.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.549 ' HA ' ' HA ' ' A' ' 61' ' ' SER . 2.1 mp -74.94 -66.78 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 N-CA-C 108.625 -0.88 . . . . 73.21 108.625 175.448 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 53.2 m -148.31 -86.5 0.09 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.274 0.629 . . . . 74.14 110.25 -176.21 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.448 ' HZ1' ' HB3' ' A' ' 118' ' ' LYS . 7.6 mtpm? -139.22 -50.05 0.51 Allowed 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 109.198 -0.667 . . . . 72.43 109.198 -178.082 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 . . . . . 0 C--O 1.251 1.132 0 N-CA-C 108.32 -0.992 . . . . 71.43 108.32 -176.026 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 mmt . . . . . 0 N--CA 1.477 0.88 0 N-CA-C 109.997 -0.371 . . . . 74.55 109.997 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -167.16 -144.17 4.03 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 111.183 -0.767 . . . . 63.13 111.183 177.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 57.81 27.89 15.16 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.187 0.995 . . . . 71.41 112.531 172.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.3 p80 -69.24 114.41 7.47 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 109.488 -0.56 . . . . 74.0 109.488 -178.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -94.52 138.27 32.63 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.607 0.763 . . . . 74.0 109.098 -178.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 -144.27 122.3 12.1 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 109.265 -0.643 . . . . 75.1 109.265 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -64.13 130.01 42.24 Favored 'General case' 0 C--O 1.24 0.557 0 O-C-N 123.871 0.732 . . . . 72.21 109.697 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.5 m80 -73.11 90.11 1.53 Allowed 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.567 -0.901 . . . . 65.31 108.567 178.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.4 t -58.92 98.52 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.288 1.035 . . . . 72.11 110.981 -176.764 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -99.29 156.39 17.01 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.661 0.784 . . . . 73.32 110.581 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 19.3 ptp -133.8 175.13 9.73 Favored 'General case' 0 C--O 1.243 0.747 0 CA-C-N 115.024 -0.989 . . . . 75.11 108.794 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -70.4 114.68 8.76 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.818 -0.628 . . . . 63.11 109.967 177.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.2 m -72.91 91.82 1.57 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.476 0.71 . . . . 71.24 109.509 176.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -91.41 151.55 20.77 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.512 0.725 . . . . 70.3 111.22 -173.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -89.75 96.97 10.93 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.804 -0.634 . . . . 73.54 109.988 -178.339 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -147.62 129.37 15.17 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.014 -1.476 . . . . 74.44 107.014 168.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.406 ' HB ' HG23 ' A' ' 106' ' ' THR . 72.9 mt -67.73 125.11 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 122.986 0.514 . . . . 74.43 110.816 -177.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.88 121.93 16.17 Favored 'General case' 0 C--O 1.242 0.666 0 O-C-N 123.902 0.751 . . . . 73.2 109.982 172.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 47.6 mm -127.16 116.59 44.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 105.915 -1.883 . . . . 73.42 105.915 172.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -101.69 151.75 21.66 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.83 -1.174 . . . . 71.04 107.83 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.8 m -122.7 112.61 18.15 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.202 -0.666 . . . . 74.13 109.202 175.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.7 mt -86.72 139.46 30.72 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.701 0.8 . . . . 60.13 110.086 176.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -78.77 144.7 34.91 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.525 0.73 . . . . 73.43 109.344 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.9 p -122.98 162.68 37.8 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 124.332 1.053 . . . . 74.41 109.667 -174.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -75.81 43.77 1.16 Allowed 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 123.008 2.472 . . . . 74.33 112.448 171.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -155.79 138.47 15.15 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.763 -0.829 . . . . 74.54 108.763 -176.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -81.39 -43.12 19.44 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.545 0.738 . . . . 71.42 110.876 178.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -67.53 -45.42 75.79 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.894 0.877 . . . . 73.44 110.31 -178.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.55 132.19 35.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.41 0.684 . . . . 60.41 110.907 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 tp -135.49 128.9 32.26 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 108.382 -0.97 . . . . 73.34 108.382 172.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -93.11 118.2 30.94 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.437 0.695 . . . . 63.44 111.5 -171.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -103.39 116.69 32.9 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.306 1.042 . . . . 75.53 108.25 172.487 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.7 tp -104.18 127.65 51.81 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.639 0.776 . . . . 71.13 110.088 -178.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.4 t -83.69 115.95 22.42 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.749 -0.834 . . . . 75.32 108.749 174.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 71.4 p -107.47 -43.46 4.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 122.825 0.45 . . . . 73.33 112.02 -171.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -102.1 -24.95 13.89 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 112.575 0.583 . . . . 75.33 112.575 -174.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -81.75 -140.51 3.18 Favored Glycine 0 C--N 1.34 0.795 0 C-N-CA 121.603 -0.332 . . . . 74.12 112.504 -175.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.511 ' HB2' HD23 ' A' ' 109' ' ' LEU . 41.0 mt-10 -99.24 -171.67 2.12 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.398 0.679 . . . . 71.44 109.763 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.478 ' HE3' ' HB3' ' A' ' 82' ' ' ASP . 13.9 ttt -106.93 143.37 35.13 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.364 -0.976 . . . . 73.04 108.364 177.867 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -75.02 -56.61 4.56 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.561 0.744 . . . . 73.54 111.371 -174.683 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.445 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.7 tp-100 -129.94 171.38 12.82 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.378 1.071 . . . . 74.52 109.127 -173.603 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.0 m -58.12 134.1 56.17 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.518 1.127 . . . . 72.23 111.759 176.496 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -59.19 124.6 20.51 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.246 1.019 . . . . 74.32 112.67 -171.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 65.45 33.85 87.6 Favored Glycine 0 C--N 1.351 1.412 0 O-C-N 123.643 0.589 . . . . 74.32 113.923 175.501 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.7 t -89.34 -178.0 5.51 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.339 0.656 . . . . 75.54 109.329 174.595 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -77.02 127.87 33.47 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 109.585 -0.524 . . . . 74.34 109.585 174.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.0 p -65.25 119.59 11.18 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.042 0.937 . . . . 73.22 111.502 -179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.0 mp -79.97 109.7 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.132 0.973 . . . . 70.43 109.028 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 96.4 t -91.94 114.81 29.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 108.664 -0.865 . . . . 65.35 108.664 178.403 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 70.4 mt -110.19 111.2 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 108.373 -0.973 . . . . 74.41 108.373 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -89.15 172.53 9.02 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 120.975 0.417 . . . . 75.23 110.25 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -65.24 -23.35 67.04 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.649 0.78 . . . . 75.43 110.935 170.582 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.2 p -79.45 -25.18 42.02 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.913 0.885 . . . . 73.24 111.145 175.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.407 ' O ' HG13 ' A' ' 58' ' ' ILE . 15.9 m-20 -83.86 55.91 3.46 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.643 0.777 . . . . 54.52 110.264 176.106 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -56.28 -35.79 67.88 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.81 0.844 . . . . 75.13 111.37 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.85 -42.67 84.92 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.123 0.969 . . . . 71.44 110.924 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.9 mt -79.13 -29.38 43.14 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.717 -0.674 . . . . 74.25 111.022 -178.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 54' ' ' ASP . 76.2 mt -63.36 -50.98 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 123.228 0.611 . . . . 75.25 109.557 175.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -59.9 -32.14 70.46 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.294 0.638 . . . . 71.25 110.572 176.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.405 ' HD2' HG22 ' A' ' 116' ' ' ILE . 5.9 t60 -78.34 -15.45 58.7 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 122.725 0.41 . . . . 73.53 111.68 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 56.8 p -124.39 113.86 18.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.71 0.404 . . . . 74.15 110.881 -178.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -53.51 -47.43 69.9 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.138 1.375 . . . . 74.11 112.105 -176.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.459 ' HB2' ' OE1' ' A' ' 108' ' ' GLN . 24.9 tp -62.01 -39.99 94.15 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.143 -0.935 . . . . 73.12 111.97 -176.22 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.36 -45.58 93.0 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.245 0.618 . . . . 55.34 111.406 -177.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -54.69 -46.14 74.06 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.515 1.134 . . . . 75.1 110.863 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.417 ' HB3' HD23 ' A' ' 104' ' ' LEU . 18.3 mm100 -63.52 -45.54 90.15 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.108 0.963 . . . . 74.33 112.137 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.8 mt -65.11 -47.51 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.119 0.568 . . . . 75.41 111.171 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -65.65 -31.84 73.09 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.305 0.642 . . . . 64.41 111.501 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.34 -57.3 7.77 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.287 0.635 . . . . 74.14 111.063 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -72.2 -29.16 63.71 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.836 -0.62 . . . . 74.13 111.546 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.561 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 63.6 m -137.73 88.58 16.09 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 108.938 -0.764 . . . . 71.21 108.938 -179.161 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.79 -3.89 12.95 Favored 'Trans proline' 0 C--N 1.379 2.156 0 C-N-CA 123.052 2.501 . . . . 75.44 113.676 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.71 -15.72 80.96 Favored Glycine 0 C--N 1.352 1.418 0 O-C-N 123.196 0.31 . . . . 73.12 112.851 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.499 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 95.7 t -67.23 122.27 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 123.372 0.669 . . . . 72.35 109.649 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -83.31 -44.93 14.36 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.807 0.843 . . . . 74.11 110.739 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 61.5 p -155.01 170.92 20.65 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.511 0.672 . . . . 63.3 111.22 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 78.8 mt -129.97 156.72 43.98 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.93 1.292 . . . . 74.14 108.661 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.547 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 50.8 ttm -130.09 100.54 5.46 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.303 -1.369 . . . . 70.33 107.303 170.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.426 HD13 HG23 ' A' ' 115' ' ' VAL . 40.7 mm -74.67 107.73 5.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 107.547 -1.279 . . . . 74.33 107.547 176.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.66 -117.09 0.28 Allowed Glycine 0 C--N 1.34 0.777 0 N-CA-C 110.063 -1.215 . . . . 64.03 110.063 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.445 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 1.6 p-10 -149.32 -57.68 0.2 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.093 0.557 . . . . 75.04 109.657 171.174 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 0.478 ' HB3' ' HE3' ' A' ' 39' ' ' MET . 7.8 p-10 -83.69 -29.58 27.46 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.864 0.466 . . . . 65.43 109.791 170.89 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -116.47 170.3 8.67 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.982 0.913 . . . . 73.31 110.814 -174.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 46.0 tp -135.12 146.05 48.45 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.313 1.445 . . . . 72.23 107.471 171.456 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.547 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 35.5 m -127.71 130.18 48.4 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 109.132 -0.692 . . . . 73.34 109.132 175.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.1 mm -108.16 128.51 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 108.894 -0.78 . . . . 75.51 108.894 -178.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -109.11 107.2 17.42 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 108.882 -0.784 . . . . 73.12 108.882 178.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.499 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -106.6 163.59 12.76 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.216 0.606 . . . . 75.12 109.716 -178.821 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.65 145.23 38.95 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 122.635 0.374 . . . . 72.44 110.282 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -58.89 -34.94 72.22 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.181 0.992 . . . . 74.15 112.869 -173.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.8 mmm -70.85 -26.02 63.08 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.124 0.57 . . . . 73.23 110.559 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.5 t -91.77 142.3 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.044 -1.095 . . . . 75.14 108.044 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -109.03 146.2 34.32 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.944 0.498 . . . . 73.13 111.116 -174.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . 0.477 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 80.4 m95 -63.14 -13.54 38.0 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.054 0.941 . . . . 63.23 112.809 178.816 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -52.56 -39.71 61.78 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.173 0.989 . . . . 74.22 112.079 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 40.5 m -103.42 -0.53 29.88 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.366 0.667 . . . . 54.43 112.211 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.561 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 57.2 mt -109.49 -50.83 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 123.322 0.649 . . . . 72.32 111.275 -171.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.0 ttpm? -55.94 -51.74 78.08 Favored Pre-proline 0 CA--C 1.561 1.398 0 CA-C-O 117.778 -1.106 . . . . 74.51 113.28 -170.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.02 -33.65 91.74 Favored 'Trans proline' 0 C--N 1.4 3.266 0 C-N-CA 121.799 1.666 . . . . 71.41 112.157 -177.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.407 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 8.0 mm-40 -65.36 -47.51 76.17 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 115.513 -0.767 . . . . 75.41 110.24 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.1 mt -70.64 -37.97 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.042 0.537 . . . . 75.14 111.497 -177.835 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 97.9 mt -54.79 -44.37 71.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 N-CA-C 109.732 -0.47 . . . . 74.43 109.732 173.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . 0.451 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 32.5 t70 -67.19 -40.74 86.55 Favored 'General case' 0 C--N 1.351 0.671 0 CA-C-N 115.039 -0.982 . . . . 72.42 111.181 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.417 HD23 ' HB3' ' A' ' 66' ' ' GLN . 95.9 mt -61.86 -39.96 93.68 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.803 0.841 . . . . 74.31 111.96 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.425 HD13 HD12 ' A' ' 63' ' ' LEU . 10.9 mp -71.06 -21.26 62.27 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.597 -0.729 . . . . 74.53 110.628 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.406 HG23 ' HB ' ' A' ' 17' ' ' ILE . 24.0 m -81.73 -37.88 26.6 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.985 -0.746 . . . . 74.11 108.985 174.742 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 103' ' ' ASP . 11.0 mmpt? -59.33 -62.57 1.78 Allowed 'General case' 0 C--N 1.368 1.388 0 C-N-CA 124.041 0.936 . . . . 73.4 110.924 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.459 ' OE1' ' HB2' ' A' ' 63' ' ' LEU . 25.9 tt0 -55.41 -47.13 76.39 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 124.658 1.224 . . . . 74.44 111.652 -171.72 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.511 HD23 ' HB2' ' A' ' 38' ' ' GLU . 82.7 mt -70.83 -30.62 67.09 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 115.459 -0.791 . . . . 74.24 111.128 -178.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.39 -26.91 61.19 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.016 0.526 . . . . 73.05 111.348 176.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -72.77 -27.05 61.78 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.762 0.425 . . . . 71.33 110.148 170.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 91.59 36.02 6.67 Favored Glycine 0 C--N 1.346 1.117 0 N-CA-C 111.543 -0.623 . . . . 72.32 111.543 -177.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -120.54 159.57 24.94 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.155 0.982 . . . . 72.42 111.203 -173.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.9 174.02 6.06 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.338 1.055 . . . . 73.13 109.093 172.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.61 HG13 HD13 ' A' ' 116' ' ' ILE . 1.9 p -74.76 -55.81 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 N-CA-C 112.909 0.707 . . . . 72.22 112.909 -171.212 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.61 HD13 HG13 ' A' ' 115' ' ' VAL . 3.1 mp -71.54 98.59 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 CA-C-O 121.766 0.794 . . . . 74.45 108.88 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 51.4 p -99.29 -157.68 0.62 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.176 1.39 . . . . 74.01 110.335 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt 66.21 26.07 10.54 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 125.0 1.32 . . . . 74.13 112.258 178.53 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 CA--C 1.558 1.259 0 C-N-CA 123.942 0.897 . . . . 63.11 109.385 -179.987 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.488 1.431 0 N-CA-C 110.453 -0.202 . . . . 72.52 110.453 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.21 48.69 6.29 Favored Glycine 0 C--N 1.342 0.878 0 CA-C-N 116.16 -0.473 . . . . 62.32 113.307 176.256 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.7 m170 -75.48 99.75 4.3 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 109.481 -0.562 . . . . 74.55 109.481 173.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -111.09 159.97 17.32 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.245 1.018 . . . . 73.43 110.762 -175.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -140.12 137.96 34.88 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.595 0.758 . . . . 71.03 109.723 177.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -138.81 134.73 33.79 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.047 0.939 . . . . 71.21 109.179 177.223 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -68.94 99.49 1.07 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.748 0.819 . . . . 74.32 111.685 -174.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.2 m170 -89.65 131.95 35.38 Favored 'General case' 0 C--O 1.243 0.725 0 N-CA-C 108.109 -1.071 . . . . 74.04 108.109 172.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 64.0 p -79.61 127.36 32.07 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.996 0.518 . . . . 74.34 110.615 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -98.35 150.68 21.33 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.0 0.52 . . . . 61.33 109.601 175.59 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -88.08 112.15 22.34 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.562 0.745 . . . . 72.21 110.337 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -75.54 95.54 3.34 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 109.065 -0.717 . . . . 72.24 109.065 170.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.2 p -64.75 92.39 0.09 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.272 0.629 . . . . 63.43 110.229 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -73.16 -50.52 22.15 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.693 0.797 . . . . 74.05 110.007 -173.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -101.72 96.66 7.23 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.986 0.898 . . . . 75.21 109.575 169.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.415 ' H ' HD23 ' A' ' 16' ' ' LEU . 2.4 pt? -113.66 111.99 22.74 Favored 'General case' 0 C--O 1.242 0.7 0 N-CA-C 106.809 -1.552 . . . . 74.22 106.809 168.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.43 HG22 HD13 ' A' ' 109' ' ' LEU . 59.2 mt -90.08 138.39 19.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 115.35 -0.841 . . . . 74.43 110.313 -171.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -62.86 99.73 0.17 Allowed 'General case' 0 CA--C 1.548 0.884 0 O-C-N 124.032 0.833 . . . . 75.02 111.042 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.0 mm -119.66 107.0 20.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 106.044 -1.836 . . . . 73.21 106.044 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -99.36 127.57 45.4 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.392 -0.595 . . . . 74.43 109.392 -172.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.5 t -91.08 126.55 36.2 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-O 121.527 0.68 . . . . 71.43 109.635 -176.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.459 HD12 HD22 ' A' ' 33' ' ' LEU . 84.3 mt -123.58 138.08 54.62 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 124.566 1.146 . . . . 73.12 108.834 -176.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 62.3 p -74.73 147.95 40.9 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.539 -0.755 . . . . 74.14 110.621 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.7 p -117.31 162.97 25.49 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 123.977 0.911 . . . . 75.23 109.922 -176.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.83 -13.19 37.99 Favored 'Trans proline' 0 C--N 1.383 2.347 0 C-N-CA 122.6 2.2 . . . . 70.2 113.094 172.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -98.88 131.51 44.91 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.438 0.695 . . . . 74.43 109.208 175.393 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.8 -30.94 70.48 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.142 0.577 . . . . 65.32 111.164 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.4 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 26.8 p-10 -95.23 2.32 54.87 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.521 0.728 . . . . 74.14 112.401 -174.443 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -111.27 156.58 21.27 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.035 0.534 . . . . 64.43 110.188 174.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.7 tp -149.38 120.19 7.59 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 108.813 -0.81 . . . . 72.34 108.813 175.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -82.43 117.94 22.84 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.849 0.86 . . . . 75.0 110.194 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -100.26 119.34 38.24 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 107.73 -1.211 . . . . 74.01 107.73 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.459 HD22 HD12 ' A' ' 22' ' ' LEU . 27.3 tp -102.2 125.59 48.94 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.706 -0.85 . . . . 73.42 108.706 -172.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.5 m -85.61 105.87 16.5 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.206 -1.405 . . . . 70.5 107.206 175.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.9 p -94.05 101.11 13.13 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.533 0.733 . . . . 74.24 109.314 -178.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.4 t70 62.26 74.87 0.42 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.758 1.223 . . . . 72.34 111.033 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -151.85 -127.94 1.37 Allowed Glycine 0 C--N 1.342 0.865 0 CA-C-N 115.033 -0.985 . . . . 75.11 111.64 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.53 ' HB2' HD22 ' A' ' 109' ' ' LEU . 56.6 mm-40 -98.06 151.73 20.04 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 117.718 0.759 . . . . 73.14 111.269 178.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 12.0 tpt -88.04 99.75 12.41 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.146 -0.934 . . . . 75.51 108.902 177.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.04 -51.18 63.03 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.685 0.794 . . . . 70.01 111.986 -170.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.469 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.7 tp-100 -100.91 157.97 16.33 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.819 -0.808 . . . . 74.22 108.819 173.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 m -83.87 31.94 0.48 Allowed 'General case' 0 CA--C 1.567 1.631 0 C-N-CA 123.858 0.863 . . . . 72.45 112.033 -174.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.77 -78.19 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 125.608 1.563 . . . . 71.54 111.431 177.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -79.89 64.29 3.92 Favored Glycine 0 C--N 1.355 1.586 0 N-CA-C 111.832 -0.507 . . . . 74.55 111.832 177.107 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.6 t -160.59 141.63 11.93 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.664 1.186 . . . . 62.32 107.984 -171.537 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -61.2 146.22 48.46 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.398 0.679 . . . . 74.23 111.559 -178.087 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.5 p -69.68 97.74 1.1 Allowed 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 109.102 -0.703 . . . . 74.12 109.102 173.221 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 72.8 mt -72.44 109.49 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 115.709 -0.678 . . . . 72.11 110.366 -170.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.5 t -85.4 106.59 15.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 107.906 -1.146 . . . . 75.14 107.906 176.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.466 HG12 ' HB3' ' A' ' 57' ' ' LEU . 59.1 mt -96.33 109.65 23.24 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.349 0 N-CA-C 107.498 -1.297 . . . . 75.12 107.498 -177.054 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -92.4 160.18 15.22 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 117.737 0.244 . . . . 73.43 110.385 -178.311 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -66.76 -21.59 66.05 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.817 0.447 . . . . 64.31 111.382 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 10.0 t -93.06 -23.78 18.53 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.861 0.864 . . . . 75.35 110.536 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.14 69.82 10.52 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.235 -0.654 . . . . 65.12 109.235 174.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -64.2 -24.61 67.74 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.982 -1.008 . . . . 75.14 110.831 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -59.74 -36.83 77.4 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.95 0.9 . . . . 71.11 110.835 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.466 ' HB3' HG12 ' A' ' 50' ' ' ILE . 88.1 mt -82.9 -28.68 29.81 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.567 0.747 . . . . 70.12 111.517 176.026 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.447 HG21 ' HG2' ' A' ' 65' ' ' GLN . 61.7 mt -65.09 -40.14 87.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.45 0.7 . . . . 73.23 110.114 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -65.97 -17.11 64.46 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.113 0.565 . . . . 63.51 112.096 175.37 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -85.79 6.57 27.42 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.169 0.588 . . . . 61.43 112.31 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.485 ' HB2' HD12 ' A' ' 116' ' ' ILE . 38.2 t -159.74 114.83 2.38 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.247 0.619 . . . . 75.43 110.512 179.167 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.417 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 3.9 tppp? -63.16 -32.7 74.16 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.703 0.401 . . . . 75.44 110.844 173.641 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.446 HD12 ' HB3' ' A' ' 104' ' ' LEU . 44.8 tp -63.73 -41.18 98.09 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 122.783 0.433 . . . . 71.44 110.367 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.61 -44.57 96.16 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 123.16 0.584 . . . . 73.21 110.324 177.604 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.447 ' HG2' HG21 ' A' ' 58' ' ' ILE . 76.2 mt-30 -55.5 -42.93 75.12 Favored 'General case' 0 C--N 1.351 0.66 0 O-C-N 124.497 1.123 . . . . 72.44 110.973 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.417 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 14.6 mm100 -69.73 -38.29 76.81 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.124 0.569 . . . . 73.25 112.427 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . 0.424 HG23 HG22 ' A' ' 74' ' ' VAL . 81.8 mt -68.32 -48.16 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 122.716 0.406 . . . . 70.24 110.473 -178.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -65.19 -32.3 73.91 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.754 -0.657 . . . . 70.25 111.391 177.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.5 tp -67.66 -56.38 9.58 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.236 0.614 . . . . 71.51 110.692 177.662 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -59.41 -34.04 71.96 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.738 0.815 . . . . 73.45 112.015 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.502 ' SG ' HG23 ' A' ' 97' ' ' ILE . 63.8 m -137.05 114.89 10.02 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 110.183 -0.303 . . . . 73.55 110.183 -176.189 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -71.72 -11.04 27.45 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.327 2.018 . . . . 73.4 111.849 171.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -88.04 18.65 39.01 Favored Glycine 0 C--N 1.355 1.601 0 CA-C-O 119.79 -0.45 . . . . 74.32 113.277 -177.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.679 HG21 ' HZ1' ' A' ' 88' ' ' LYS . 15.1 t -97.54 124.79 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 108.794 -0.817 . . . . 75.43 108.794 172.26 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -84.2 -52.21 6.43 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.656 0.382 . . . . 73.25 110.297 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 97.1 p -156.18 172.31 18.67 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 112.057 0.391 . . . . 70.14 112.057 -177.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 34.5 mt -131.47 126.03 33.98 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 108.226 -1.027 . . . . 74.3 108.226 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.479 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.3 ttm -100.92 111.56 23.8 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.775 -0.824 . . . . 73.43 108.775 178.716 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.613 HD12 HD13 ' A' ' 84' ' ' LEU . 20.9 mm -86.16 98.05 6.48 Favored 'Isoleucine or valine' 0 C--N 1.349 0.564 0 N-CA-C 108.82 -0.807 . . . . 75.33 108.82 -177.884 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.06 176.27 42.15 Favored Glycine 0 C--O 1.243 0.715 0 N-CA-C 111.174 -0.77 . . . . 60.0 111.174 176.019 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.469 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 31.1 m-20 -51.48 -59.74 3.92 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.265 1.026 . . . . 74.1 111.611 -176.216 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -128.5 22.46 5.97 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.153 -1.385 . . . . 74.44 110.016 -174.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . 0.414 ' HB3' HD13 ' A' ' 33' ' ' LEU . 37.0 p90 -149.12 154.94 39.95 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 122.895 0.478 . . . . 74.54 110.789 -175.162 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.613 HD13 HD12 ' A' ' 79' ' ' ILE . 27.5 tp -131.34 110.95 11.44 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 108.082 -1.081 . . . . 73.22 108.082 176.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.479 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 41.7 m -100.01 109.73 22.05 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 108.48 -0.934 . . . . 70.24 108.48 -176.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.532 HG13 HD13 ' A' ' 101' ' ' ILE . 20.9 mm -86.38 131.71 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 N-CA-C 108.012 -1.107 . . . . 72.02 108.012 -175.362 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -112.0 124.44 52.4 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.017 -1.105 . . . . 74.14 108.017 178.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.679 ' HZ1' HG21 ' A' ' 74' ' ' VAL . 69.1 mttm -129.12 177.39 7.18 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.318 1.047 . . . . 73.55 109.475 -178.307 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.11 139.37 58.76 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.49 0.494 . . . . 72.3 109.956 168.597 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -62.1 -27.52 68.98 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.661 0.784 . . . . 74.3 112.571 -174.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 26.4 mmt -87.38 -16.72 34.14 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.584 0.354 . . . . 74.01 111.659 -178.111 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 72.6 t -75.57 133.76 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.395 -0.965 . . . . 73.5 108.395 173.049 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 65.5 m170 -104.53 148.88 25.99 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.25 0.548 . . . . 74.43 110.33 -176.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -76.94 -19.13 57.74 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.134 0.974 . . . . 75.55 112.262 -173.278 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -57.7 -26.95 62.45 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.901 0.48 . . . . 74.55 111.667 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -82.81 -52.49 6.69 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 122.961 0.505 . . . . 75.44 111.989 177.215 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.502 HG23 ' SG ' ' A' ' 71' ' ' CYS . 26.8 mt -93.94 -33.46 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 113.133 0.79 . . . . 74.12 113.133 -164.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -49.43 -46.74 78.16 Favored Pre-proline 0 CA--C 1.568 1.667 0 CA-C-O 117.564 -1.207 . . . . 75.5 113.784 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -56.0 -35.59 94.76 Favored 'Trans proline' 0 C--N 1.396 3.029 0 CA-C-N 121.626 1.616 . . . . 73.14 112.844 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -73.16 -34.83 66.27 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.207 0.603 . . . . 71.44 110.595 -179.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.532 HD13 HG13 ' A' ' 86' ' ' ILE . 84.0 mt -68.5 -49.06 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.481 0.712 . . . . 75.32 109.921 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 87.1 mt -58.23 -38.07 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.594 0.758 . . . . 74.2 110.301 177.306 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -61.98 -51.53 67.69 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.829 0.852 . . . . 73.42 110.923 176.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.446 ' HB3' HD12 ' A' ' 63' ' ' LEU . 69.7 mt -62.9 -39.38 94.33 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.09 0.956 . . . . 73.4 111.92 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.474 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 8.5 mp -70.42 -28.55 65.14 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.398 0.679 . . . . 63.13 110.5 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 94.8 m -69.58 -37.06 76.82 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 109.111 -0.699 . . . . 74.11 109.111 174.743 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -67.9 -44.95 75.76 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.053 0.541 . . . . 72.23 110.328 178.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -58.23 -47.23 84.18 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.447 1.099 . . . . 75.55 111.017 -178.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.53 HD22 ' HB2' ' A' ' 38' ' ' GLU . 18.0 mt -76.4 -26.55 55.7 Favored 'General case' 0 CA--C 1.553 1.08 0 CA-C-N 115.821 -0.627 . . . . 73.3 110.708 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.26 -21.88 60.52 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.042 0.537 . . . . 74.11 111.69 178.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -69.4 -24.81 63.9 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 110.133 -0.321 . . . . 71.52 110.133 170.357 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 71.76 38.52 60.82 Favored Glycine 0 C--N 1.347 1.161 0 N-CA-C 111.079 -0.808 . . . . 73.44 111.079 -174.395 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -135.59 160.4 38.62 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 124.11 0.964 . . . . 71.31 111.643 -173.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -78.93 152.59 31.01 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 114.404 -1.271 . . . . 74.11 109.293 177.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.584 HG12 HG12 ' A' ' 116' ' ' ILE . 7.8 p -76.44 -36.91 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 122.839 0.456 . . . . 73.54 110.535 178.489 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.584 HG12 HG12 ' A' ' 115' ' ' VAL . 43.7 mm -114.83 151.12 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.356 1.062 . . . . 75.12 108.937 178.007 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 37.5 t -88.99 172.99 8.72 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.029 0.532 . . . . 72.32 110.092 175.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . 0.536 ' HB2' ' HZ1' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -74.61 -16.81 60.78 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.269 0.628 . . . . 74.14 110.696 173.691 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 . . . . . 0 C--O 1.253 1.275 0 C-N-CA 124.45 1.1 . . . . 72.11 110.535 -178.485 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.452 ' N ' ' SD ' ' A' ' 1' ' ' MET . 1.1 mpt? . . . . . 0 N--CA 1.484 1.239 0 N-CA-C 109.707 -0.479 . . . . 75.33 109.707 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.95 45.96 1.06 Allowed Glycine 0 C--N 1.348 1.212 0 O-C-N 123.344 0.402 . . . . 71.14 112.151 -177.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -156.38 154.68 30.9 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.29 1.036 . . . . 75.12 108.238 178.472 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 26.8 p80 -149.73 169.21 21.58 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.329 0.651 . . . . 74.22 109.629 179.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.4 p-80 -150.95 136.51 17.9 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.659 0.384 . . . . 75.04 110.53 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -116.29 169.98 8.88 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.167 0.987 . . . . 64.51 109.329 173.076 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -135.97 103.22 5.29 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.831 0.852 . . . . 74.2 110.081 -175.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 38.1 m-70 -103.65 104.05 14.04 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.627 0.771 . . . . 74.01 109.439 177.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -90.23 61.99 5.29 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 108.548 -0.908 . . . . 73.45 108.548 173.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -76.98 94.65 4.0 Favored 'General case' 0 C--N 1.351 0.646 0 CA-C-N 115.302 -0.863 . . . . 62.45 109.814 -176.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ttt -72.39 91.84 1.39 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 115.573 -0.74 . . . . 71.34 110.212 177.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.3 p-10 -93.79 148.91 21.69 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 108.808 -0.812 . . . . 71.45 108.808 171.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.4 t -143.36 109.85 5.44 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.483 -0.562 . . . . 73.4 109.483 -177.529 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -145.37 150.13 36.02 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 124.356 1.063 . . . . 72.42 108.218 175.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -85.67 106.18 16.76 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 109.769 -0.456 . . . . 75.13 109.769 -175.765 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.6 mp -76.38 91.24 3.26 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.195 -0.669 . . . . 74.24 109.195 174.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.434 ' H ' HG22 ' A' ' 106' ' ' THR . 64.5 mt -59.51 110.44 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 114.58 -1.191 . . . . 74.45 109.304 174.583 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -71.89 136.18 46.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.521 -0.763 . . . . 74.51 109.229 -176.747 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 48.9 mm -118.55 143.32 29.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 N-CA-C 107.9 -1.148 . . . . 64.33 107.9 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.454 ' HD2' HD22 ' A' ' 33' ' ' LEU . 40.4 ttmt -91.49 114.97 27.64 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.421 -0.585 . . . . 64.22 109.421 -177.516 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 97.6 m -95.05 120.88 36.01 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 108.93 -0.767 . . . . 74.54 108.93 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.6 mt -125.23 141.91 51.81 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.333 1.053 . . . . 72.43 109.536 -174.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.6 p -73.97 143.37 45.67 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.143 0.577 . . . . 72.24 110.44 174.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.3 p -111.95 160.89 28.19 Favored Pre-proline 0 N--CA 1.478 0.947 0 C-N-CA 124.245 1.018 . . . . 74.13 109.401 -178.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -79.29 30.85 0.47 Allowed 'Trans proline' 0 C--N 1.375 1.95 0 C-N-CA 123.192 2.595 . . . . 73.34 112.855 172.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -142.28 127.43 18.57 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.398 -0.964 . . . . 74.23 108.398 -177.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -73.2 158.22 35.66 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.382 -0.599 . . . . 63.12 109.382 173.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 70.49 -6.46 1.19 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.113 1.365 . . . . 74.35 111.68 -173.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.415 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -117.57 145.51 44.23 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 124.101 0.961 . . . . 75.11 109.758 -172.598 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.6 tp -153.2 129.69 10.67 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 108.864 -0.791 . . . . 75.54 108.864 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -82.82 131.53 35.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.754 0.821 . . . . 74.25 111.127 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -122.19 114.37 20.76 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.977 -1.49 . . . . 73.21 106.977 172.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.454 HD22 ' HD2' ' A' ' 20' ' ' LYS . 52.7 tp -113.86 127.92 56.19 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 123.983 0.913 . . . . 74.41 110.269 -165.782 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 m -90.29 103.73 16.38 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.156 -1.053 . . . . 73.54 108.156 177.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 73.5 p -102.34 -11.45 18.66 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.966 0.907 . . . . 72.44 111.578 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -62.88 -44.93 94.79 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.943 0.897 . . . . 73.43 111.875 -177.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 150.83 -32.4 0.98 Allowed Glycine 0 C--N 1.346 1.108 0 CA-C-N 116.277 -0.42 . . . . 53.32 113.184 178.852 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -69.98 106.66 3.28 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.036 0.446 . . . . 74.33 109.829 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.5 tpt -85.2 133.97 34.17 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.319 1.048 . . . . 75.53 109.865 -171.606 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.415 ' O ' HG11 ' A' ' 115' ' ' VAL . 73.5 mt -70.46 -35.59 73.41 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.473 0.709 . . . . 73.41 112.756 -172.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -141.53 165.6 27.05 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 107.874 -1.158 . . . . 75.11 107.874 172.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 29.9 m -60.57 121.63 12.66 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 123.355 0.409 . . . . 63.41 110.063 178.289 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -54.92 118.07 3.97 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.259 1.024 . . . . 74.43 111.674 -168.144 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.57 11.45 14.9 Favored Glycine 0 C--N 1.34 0.772 0 CA-C-N 115.342 -0.845 . . . . 75.13 111.962 -170.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.55 ' HB3' ' HB3' ' A' ' 81' ' ' ASP . 35.1 t -84.8 156.75 21.22 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.647 0.779 . . . . 73.11 110.908 179.629 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -81.22 154.28 26.73 Favored 'General case' 0 C--O 1.246 0.892 0 C-N-CA 123.932 0.893 . . . . 73.11 110.116 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.0 p -79.39 91.47 5.09 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.902 0.481 . . . . 72.23 109.825 176.345 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.3 mt -75.77 116.69 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.018 0.927 . . . . 75.31 109.866 -176.904 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.5 t -90.88 119.28 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 108.579 -0.897 . . . . 72.34 108.579 178.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.404 HG21 ' HB2' ' A' ' 57' ' ' LEU . 61.3 mt -117.11 110.65 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 107.775 -1.194 . . . . 72.13 107.775 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.528 ' HB2' ' HZ2' ' A' ' 51' ' ' LYS . 10.2 mtmp? -93.29 172.58 8.2 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 109.595 -0.52 . . . . 74.15 109.595 177.643 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.9 p30 -64.7 -21.15 66.68 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.212 0.605 . . . . 70.15 112.345 -177.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.5 t -83.92 -21.18 31.95 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 122.507 0.323 . . . . 74.23 110.717 176.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -83.23 56.33 3.49 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.999 0.92 . . . . 73.42 110.296 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.414 ' HA ' HD13 ' A' ' 58' ' ' ILE . 34.5 tt0 -63.73 -25.72 68.32 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.457 0.703 . . . . 63.22 111.667 -175.096 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.18 -45.51 93.08 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.79 0.836 . . . . 74.55 110.281 173.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.45 ' HA ' ' HD2' ' A' ' 60' ' ' HIS . 87.0 mt -73.29 -30.03 63.13 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 115.703 -0.681 . . . . 75.14 111.106 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.414 HD13 ' HA ' ' A' ' 55' ' ' GLU . 75.5 mt -65.28 -39.06 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.203 0.601 . . . . 73.03 109.427 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -70.68 -10.85 60.34 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 112.965 0.728 . . . . 73.21 112.965 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.45 ' HD2' ' HA ' ' A' ' 57' ' ' LEU . 83.2 m-70 -80.79 -34.3 34.19 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.701 0.4 . . . . 61.53 110.619 170.561 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.48 ' HB2' HD13 ' A' ' 116' ' ' ILE . 39.3 t -108.65 106.78 16.98 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.326 0.65 . . . . 61.43 110.611 -177.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -54.77 -37.51 66.09 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.392 0.677 . . . . 72.15 110.809 173.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.13 -42.55 99.52 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.537 0.735 . . . . 74.11 111.033 178.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.79 -45.08 93.41 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 122.819 0.448 . . . . 72.41 109.833 178.638 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -55.95 -44.38 78.37 Favored 'General case' 0 C--N 1.353 0.734 0 O-C-N 124.065 0.853 . . . . 74.13 110.812 177.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -62.36 -46.56 88.09 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.69 0.796 . . . . 75.1 112.069 178.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.9 mt -64.71 -49.83 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 C-N-CA 123.641 0.776 . . . . 61.44 111.065 -175.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -66.76 -36.19 81.85 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.417 0.687 . . . . 72.2 111.502 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.9 tp -64.99 -46.6 80.76 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.444 0.698 . . . . 74.33 110.835 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . 0.471 ' NE2' HD22 ' A' ' 104' ' ' LEU . 75.3 mt-30 -73.21 -28.92 62.45 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.123 -0.944 . . . . 63.3 111.642 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.468 ' SG ' HD12 ' A' ' 97' ' ' ILE . 42.9 t -149.08 104.16 3.36 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 122.47 0.308 . . . . 73.34 110.783 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -78.08 14.55 1.51 Allowed 'Trans proline' 0 C--N 1.373 1.816 0 C-N-CA 122.738 2.292 . . . . 64.05 112.745 171.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -85.77 -18.42 59.9 Favored Glycine 0 C--N 1.35 1.322 0 N-CA-C 111.764 -0.535 . . . . 75.03 111.764 170.184 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.413 ' HA ' ' HB3' ' A' ' 88' ' ' LYS . 87.7 t -70.74 114.59 8.89 Favored 'Isoleucine or valine' 0 C--N 1.351 0.669 0 N-CA-C 109.228 -0.656 . . . . 70.24 109.228 175.402 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -86.02 -32.95 21.19 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.264 0.626 . . . . 72.51 110.678 -174.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.412 ' HB2' ' HG2' ' A' ' 51' ' ' LYS . 33.4 t -161.45 167.14 26.13 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 121.345 0.593 . . . . 73.33 111.319 -175.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 76.7 mt -134.4 128.61 33.92 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.721 1.208 . . . . 74.42 107.928 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.468 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 54.1 ttm -96.21 108.18 20.61 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 107.371 -1.344 . . . . 74.41 107.371 168.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 20.1 mm -91.33 105.38 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.437 0.695 . . . . 74.04 109.146 -174.562 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.87 163.29 24.5 Favored Glycine 0 C--O 1.242 0.636 0 N-CA-C 109.657 -1.377 . . . . 61.52 109.657 173.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . 0.55 ' HB3' ' HB3' ' A' ' 45' ' ' SER . 19.3 p-10 -74.08 -34.92 64.18 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 122.885 0.474 . . . . 71.32 110.595 175.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -99.55 -32.86 10.89 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.933 0.893 . . . . 73.04 111.259 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -131.28 169.28 16.19 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.276 0.63 . . . . 74.2 111.739 -170.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 54.2 tp -141.12 109.94 6.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.625 0.77 . . . . 73.42 109.619 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.468 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 59.8 m -100.79 111.57 23.82 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.713 -0.847 . . . . 74.51 108.713 -178.403 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.514 HG13 HD12 ' A' ' 101' ' ' ILE . 27.2 mm -86.99 126.22 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.487 -0.931 . . . . 71.42 108.487 -176.753 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -108.52 124.63 50.75 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.355 -0.98 . . . . 71.53 108.355 176.61 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.417 ' HD2' HD13 ' A' ' 97' ' ' ILE . 0.6 OUTLIER -150.2 152.96 35.45 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.228 1.011 . . . . 75.04 109.154 -177.042 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -60.57 132.32 53.54 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.203 0.601 . . . . 65.22 110.427 -172.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -62.39 -23.4 66.81 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.633 1.173 . . . . 75.12 112.493 -175.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.2 mmt -66.21 -30.86 71.39 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.865 0.466 . . . . 75.45 110.679 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.6 t -92.98 142.83 12.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 N-CA-C 107.151 -1.426 . . . . 73.51 107.151 172.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -102.72 156.82 17.38 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.34 0.59 . . . . 64.31 111.579 -176.204 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -69.02 -17.84 63.96 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 114.629 -1.169 . . . . 64.13 111.795 179.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -56.01 -31.08 62.75 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.756 0.822 . . . . 74.43 111.806 -177.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.9 m -92.08 -36.17 13.5 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.382 0.673 . . . . 64.31 112.034 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.468 HD12 ' SG ' ' A' ' 71' ' ' CYS . 30.4 mt -97.74 -43.15 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 N-CA-C 112.305 0.483 . . . . 72.42 112.305 -164.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -51.78 -46.15 91.86 Favored Pre-proline 0 N--CA 1.492 1.634 0 CA-C-O 117.76 -1.114 . . . . 73.4 113.68 -177.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -53.83 -41.88 70.98 Favored 'Trans proline' 0 C--N 1.402 3.361 0 C-N-CA 121.839 1.693 . . . . 73.14 112.337 173.02 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -67.66 -39.48 84.56 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.345 -0.843 . . . . 70.35 110.486 -178.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.514 HD12 HG13 ' A' ' 86' ' ' ILE . 93.7 mt -62.89 -51.54 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.572 0.749 . . . . 72.45 110.395 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 83.7 mt -59.8 -38.28 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 O-C-N 123.748 0.655 . . . . 73.11 110.682 -178.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -67.94 -39.31 83.46 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.018 0.927 . . . . 71.24 111.278 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.471 HD22 ' NE2' ' A' ' 70' ' ' GLN . 77.7 mt -65.72 -39.99 91.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.565 0.746 . . . . 73.11 111.799 174.058 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.434 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 10.8 mp -68.99 -25.0 64.3 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.032 0.533 . . . . 75.02 110.36 176.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.434 HG22 ' H ' ' A' ' 17' ' ' ILE . 88.6 m -71.61 -50.91 26.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 122.984 0.514 . . . . 73.31 110.038 176.748 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -65.67 -36.47 83.75 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 123.386 0.429 . . . . 73.52 110.879 -176.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -59.41 -56.33 23.37 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 122.72 0.408 . . . . 64.54 110.62 177.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.434 ' HG ' ' O ' ' A' ' 105' ' ' LEU . 50.2 mt -69.65 -22.47 63.45 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 123.792 0.683 . . . . 74.42 111.333 -176.653 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.67 -35.84 70.43 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.567 0.747 . . . . 75.12 111.888 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -108.26 -13.47 14.89 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 122.952 0.501 . . . . 74.11 111.474 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -148.7 -159.12 8.35 Favored Glycine 0 C--N 1.345 1.063 0 N-CA-C 112.082 -0.407 . . . . 75.01 112.082 -175.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -131.85 -60.17 0.93 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.754 0.822 . . . . 72.11 109.106 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -79.87 171.38 15.19 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.31 -1.314 . . . . 65.2 111.98 -174.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.472 HG13 HG12 ' A' ' 116' ' ' ILE . 5.4 p -110.95 -37.75 3.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-N 114.085 -1.416 . . . . 74.31 109.874 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.48 HD13 ' HB2' ' A' ' 61' ' ' SER . 41.9 mm -92.06 -80.51 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 122.743 0.417 . . . . 75.42 109.882 -178.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.7 m -152.3 156.36 39.48 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.871 0.469 . . . . 70.12 111.153 -171.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -125.32 31.16 5.63 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.379 1.072 . . . . 75.23 108.86 173.263 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 . . . . . 0 C--O 1.251 1.137 0 C-N-CA 124.105 0.962 . . . . 71.54 109.04 179.693 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.421 ' SD ' ' N ' ' A' ' 1' ' ' MET . 3.1 mpp? . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 109.314 -0.625 . . . . 72.15 109.314 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 130.29 122.17 2.39 Favored Glycine 0 C--N 1.34 0.79 0 N-CA-C 110.747 -0.941 . . . . 71.35 110.747 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 39.4 p-80 -149.91 112.14 4.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.341 0.656 . . . . 73.13 109.509 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -162.27 108.65 1.27 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.746 0.818 . . . . 74.42 109.406 178.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -156.36 41.02 0.36 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.201 1.001 . . . . 70.34 109.473 -177.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -66.57 147.72 52.89 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.81 0.844 . . . . 75.3 111.478 -177.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 -111.35 143.07 42.75 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.901 0.88 . . . . 73.13 110.259 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -175.01 121.53 0.22 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.125 0.97 . . . . 72.45 108.998 168.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.1 m -141.99 114.94 8.68 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.272 0.629 . . . . 72.2 110.833 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -90.14 139.55 30.52 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.587 0.755 . . . . 75.14 109.504 174.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.1 ptp -149.8 104.78 3.35 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.209 0.528 . . . . 75.42 110.366 -176.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -159.24 111.0 2.11 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 108.939 -0.763 . . . . 72.53 108.939 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 t -92.08 7.46 42.28 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.701 0.8 . . . . 74.41 111.156 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -89.69 157.69 17.88 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.775 0.83 . . . . 72.55 110.001 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.51 134.76 19.39 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 108.553 -0.906 . . . . 74.14 108.553 170.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -116.68 162.79 17.11 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.007 0.523 . . . . 63.35 110.296 -178.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.426 ' HB ' ' HA ' ' A' ' 106' ' ' THR . 69.0 mt -79.26 117.86 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 123.608 0.763 . . . . 73.52 110.78 -177.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -83.1 131.13 35.16 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 124.568 1.147 . . . . 75.5 110.47 -175.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . 0.407 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.9 mm -130.17 121.32 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 N-CA-C 108.059 -1.089 . . . . 74.22 108.059 -175.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -90.77 143.34 26.83 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.732 1.213 . . . . 75.23 110.021 -179.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 47.1 m -101.83 120.28 40.12 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 123.43 0.692 . . . . 75.21 109.727 175.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.8 mt -125.16 138.17 54.15 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.133 0.973 . . . . 74.13 109.633 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.5 p -86.66 144.46 27.13 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.06 0.544 . . . . 74.34 110.615 178.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.4 p -108.34 172.78 3.44 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 124.875 1.27 . . . . 75.24 108.469 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -75.57 50.56 2.72 Favored 'Trans proline' 0 C--N 1.376 2.001 0 C-N-CA 122.13 1.887 . . . . 74.45 112.372 168.688 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -162.27 141.14 9.21 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.344 1.058 . . . . 73.54 108.504 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.29 -31.94 13.86 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.137 0.575 . . . . 62.44 110.593 -177.899 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -89.78 7.49 36.65 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.916 0.886 . . . . 74.15 111.798 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.46 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -136.53 126.17 25.4 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.796 0.838 . . . . 63.22 109.052 174.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.1 tp -128.42 134.24 48.74 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.461 0.704 . . . . 74.41 109.177 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -90.87 129.74 36.89 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.479 1.111 . . . . 75.25 110.538 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -114.7 116.41 28.65 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.717 -1.216 . . . . 75.34 107.717 171.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.4 tp -100.06 127.32 46.31 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.451 -1.314 . . . . 75.02 107.451 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.2 t -72.39 107.33 4.91 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 107.254 -1.388 . . . . 73.25 107.254 171.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t -105.64 18.97 21.33 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.474 0.654 . . . . 75.02 109.73 -179.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -91.32 -55.5 3.49 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.368 0.667 . . . . 64.44 109.888 177.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 156.65 -17.13 0.41 Allowed Glycine 0 C--N 1.344 1.024 0 CA-C-N 115.908 -0.587 . . . . 62.23 113.171 -175.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -84.92 105.76 15.93 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.24 0.616 . . . . 73.3 111.229 -176.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 40.2 ttm -74.97 132.91 41.73 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.502 -0.555 . . . . 75.11 109.502 175.212 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.3 mt -62.64 -48.72 78.12 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.826 0.704 . . . . 73.22 111.342 -177.239 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -132.5 -84.77 0.48 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.182 -0.463 . . . . 73.44 109.843 -179.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 94.9 m -162.33 146.2 11.91 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.958 0.903 . . . . 72.22 108.578 -174.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.0 ppt_? -72.6 144.05 48.0 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.622 0.369 . . . . 73.22 111.447 173.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 80.49 21.8 63.64 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.754 -0.657 . . . . 71.41 113.13 -178.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m -91.97 159.79 15.57 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.191 0.597 . . . . 75.25 110.79 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -97.3 126.6 42.63 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.755 -1.202 . . . . 75.13 107.755 170.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.8 m -59.56 121.53 11.8 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.853 0.861 . . . . 75.51 112.995 -169.489 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 61.4 mt -87.34 130.89 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.011 0.925 . . . . 72.51 110.085 -178.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.5 t -97.46 108.64 21.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 N-CA-C 109.263 -0.643 . . . . 75.35 109.263 178.646 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 72.1 mt -90.38 110.04 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.549 1.14 . . . . 75.33 107.961 175.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -84.24 144.36 28.98 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.544 0.738 . . . . 72.43 110.205 -174.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 31.8 p-10 -65.79 -29.27 69.73 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.086 0.554 . . . . 72.15 111.321 175.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 t -82.15 -14.38 55.76 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.818 0.847 . . . . 75.13 111.208 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -102.61 82.46 2.15 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.232 -1.025 . . . . 74.14 108.232 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.5 -25.05 59.21 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.117 0.967 . . . . 75.04 112.519 -178.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -65.39 -52.68 51.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.201 0.601 . . . . 74.34 110.992 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.45 -36.18 77.61 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.951 0.5 . . . . 73.03 110.39 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 68.8 mt -64.46 -47.12 90.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 115.023 -0.99 . . . . 72.22 110.522 177.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . 0.431 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 91.2 m-20 -62.12 -32.19 72.73 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.334 0.654 . . . . 75.34 112.42 -178.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -80.08 -6.47 57.73 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.018 0.527 . . . . 75.31 112.047 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.4 p -131.65 104.46 6.94 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.426 0.691 . . . . 74.11 109.558 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -52.21 -38.28 57.47 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.146 0.978 . . . . 75.2 112.285 -178.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.469 HD13 HD11 ' A' ' 105' ' ' LEU . 22.7 tp -61.89 -42.29 98.9 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 123.975 0.797 . . . . 73.2 111.769 179.098 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.47 -44.12 95.37 Favored 'General case' 0 C--N 1.351 0.669 0 O-C-N 123.66 0.6 . . . . 74.32 110.804 -177.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.431 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 98.6 mt-30 -54.86 -48.04 73.43 Favored 'General case' 0 C--N 1.348 0.525 0 O-C-N 124.122 0.889 . . . . 74.54 110.643 176.579 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -63.48 -44.62 93.87 Favored 'General case' 0 CA--C 1.552 1.028 0 O-C-N 123.87 0.731 . . . . 72.35 112.84 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -65.77 -49.68 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 123.328 0.651 . . . . 73.31 110.868 -176.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -69.93 -30.0 67.29 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.656 0.382 . . . . 74.44 111.809 -178.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 67.1 tp -64.11 -48.72 75.01 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.59 0.756 . . . . 72.41 110.693 175.771 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -86.78 -16.88 34.93 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.068 -0.969 . . . . 74.2 111.943 -173.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 54.0 t -149.44 104.62 3.29 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 122.928 0.491 . . . . 73.51 110.383 177.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -78.94 5.72 5.49 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.671 2.247 . . . . 71.42 112.765 172.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.23 -26.68 67.76 Favored Glycine 0 C--N 1.354 1.539 0 N-CA-C 112.262 -0.335 . . . . 44.21 112.262 176.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.408 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 40.7 t -75.36 127.73 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.056 0.542 . . . . 75.32 110.368 -176.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -89.06 -36.43 15.78 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.282 1.033 . . . . 74.43 111.026 -177.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.1 p -164.63 162.02 21.24 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 121.339 0.59 . . . . 62.51 111.633 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.9 mt -118.72 131.14 56.13 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.609 1.163 . . . . 70.54 108.168 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.508 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 43.0 ttm -105.21 103.85 13.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.407 -0.96 . . . . 54.35 108.407 175.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.477 HD12 HD11 ' A' ' 84' ' ' LEU . 49.3 mm -82.38 106.92 13.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 124.447 1.099 . . . . 75.13 108.773 -177.024 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.54 -163.9 39.55 Favored Glycine 0 C--O 1.246 0.863 0 O-C-N 123.688 0.617 . . . . 74.24 111.876 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -64.24 -66.16 0.58 Allowed 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.61 0.719 . . . . 65.34 110.036 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -127.89 10.57 6.51 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 114.055 -1.43 . . . . 73.11 109.603 -175.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -132.52 153.59 50.79 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.987 0.915 . . . . 73.55 110.344 -174.88 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.477 HD11 HD12 ' A' ' 79' ' ' ILE . 46.0 tp -131.64 117.96 19.39 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.221 1.008 . . . . 63.03 109.524 -175.855 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.508 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 28.9 m -105.16 111.43 24.19 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.288 -0.634 . . . . 75.0 109.288 -178.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.507 HG13 HD11 ' A' ' 101' ' ' ILE . 22.4 mm -88.01 126.99 41.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 123.31 0.644 . . . . 73.54 109.335 -175.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -104.2 109.61 21.5 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.227 -1.027 . . . . 70.32 108.227 174.419 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.84 166.24 10.62 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.617 0.767 . . . . 61.21 111.047 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -69.42 142.91 53.75 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 124.214 0.946 . . . . 63.14 110.117 175.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -54.9 -29.25 55.41 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 124.494 1.118 . . . . 72.01 113.429 -173.564 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 90.6 mmm -83.54 -31.72 26.25 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.128 0.571 . . . . 65.01 111.913 -178.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . 0.49 HG11 HD12 ' A' ' 97' ' ' ILE . 17.9 t -88.23 122.95 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 109.592 -0.521 . . . . 74.34 109.592 -170.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -95.18 152.02 18.71 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.243 0.617 . . . . 65.0 111.281 -166.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -62.3 -26.21 68.29 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.725 0.81 . . . . 75.11 112.683 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -51.74 -33.42 34.62 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.024 0.929 . . . . 74.4 112.487 -178.478 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 43.0 p -91.46 -45.49 8.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.302 0.641 . . . . 74.52 111.416 178.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.49 HD12 HG11 ' A' ' 92' ' ' VAL . 4.9 mt -79.89 -47.15 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 122.409 0.283 . . . . 74.41 110.959 -163.775 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -50.77 -53.17 49.87 Favored Pre-proline 0 N--CA 1.487 1.389 0 N-CA-C 114.845 1.424 . . . . 73.43 114.845 -170.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.32 -36.19 95.09 Favored 'Trans proline' 0 C--N 1.385 2.461 0 C-N-CA 121.784 1.656 . . . . 74.34 112.396 -177.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.41 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 45.2 mt-10 -76.83 -30.84 56.52 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 114.819 -1.082 . . . . 75.43 111.503 -177.138 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.507 HD11 HG13 ' A' ' 86' ' ' ILE . 69.1 mt -66.32 -52.7 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 N-CA-C 109.604 -0.517 . . . . 74.44 109.604 173.015 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . 0.407 HG23 ' HB ' ' A' ' 19' ' ' ILE . 73.6 mt -57.66 -37.41 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 123.967 0.792 . . . . 72.13 110.745 -178.032 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -58.97 -44.22 91.49 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.931 0.893 . . . . 65.53 111.165 175.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 81.8 mt -67.72 -33.35 74.71 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.673 0.789 . . . . 73.34 111.548 177.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.469 HD11 HD13 ' A' ' 63' ' ' LEU . 11.1 mp -70.09 -22.7 63.01 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.14 0.576 . . . . 75.24 110.696 174.225 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.426 ' HA ' ' HB ' ' A' ' 17' ' ' ILE . 25.3 m -82.45 -35.83 27.15 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 109.459 -0.571 . . . . 73.13 109.459 177.653 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -71.87 -64.23 0.98 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.187 0.595 . . . . 75.01 111.798 178.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.444 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 2.8 tt0 -58.79 -48.65 80.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.149 0.579 . . . . 75.12 112.1 -167.181 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.87 -25.46 66.69 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 124.072 0.858 . . . . 72.02 111.919 -176.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.05 -30.1 63.47 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.52 0.728 . . . . 75.53 111.332 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -87.45 -27.44 22.7 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.265 0.626 . . . . 73.25 110.463 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 177.28 123.86 0.81 Allowed Glycine 0 C--N 1.341 0.841 0 N-CA-C 111.492 -0.643 . . . . 54.5 111.492 -176.349 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -26.34 67.86 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.186 0.994 . . . . 73.34 112.118 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -60.59 102.16 0.17 Allowed 'General case' 0 CA--C 1.545 0.781 0 O-C-N 123.507 0.505 . . . . 71.32 110.913 173.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.518 HG11 HG13 ' A' ' 116' ' ' ILE . 8.1 p -61.86 -46.81 95.7 Favored 'Isoleucine or valine' 0 C--N 1.353 0.761 0 N-CA-C 109.365 -0.606 . . . . 74.21 109.365 169.873 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.518 HG13 HG11 ' A' ' 115' ' ' VAL . 49.0 mt -100.6 83.71 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 106.216 -1.772 . . . . 71.02 106.216 171.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 4.4 p -71.67 101.74 2.61 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.258 -1.016 . . . . 75.35 108.258 175.116 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -66.42 -51.15 59.91 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.262 -0.427 . . . . 74.14 111.094 -175.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 . . . . . 0 C--O 1.252 1.202 0 C-N-CA 124.817 1.247 . . . . 74.5 107.714 -179.331 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 ptm . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.544 -0.539 . . . . 72.02 109.544 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.2 80.99 0.05 OUTLIER Glycine 0 C--N 1.346 1.135 0 N-CA-C 111.896 -0.482 . . . . 74.05 111.896 -177.745 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 -82.25 75.35 9.18 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.688 0.795 . . . . 74.15 109.885 -178.428 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -146.64 153.62 40.52 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.713 1.205 . . . . 73.21 109.746 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -159.98 105.87 1.58 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.16 0.984 . . . . 73.32 109.292 -176.83 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -105.73 144.02 33.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.526 0.73 . . . . 74.14 109.731 -177.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -84.5 115.56 22.64 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 108.879 -0.786 . . . . 75.51 108.879 179.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -127.14 131.22 50.81 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.586 0.754 . . . . 74.2 109.874 179.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.4 m -154.16 87.92 1.22 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.514 1.126 . . . . 70.31 108.887 176.427 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -97.39 122.1 40.05 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.258 0.623 . . . . 73.41 109.546 176.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -80.79 69.02 7.25 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.699 0.8 . . . . 73.14 109.964 178.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -77.01 -26.95 54.41 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.062 -0.972 . . . . 74.24 110.96 -177.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.0 p -73.9 87.39 1.79 Allowed 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 109.003 -0.74 . . . . 74.31 109.003 170.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -152.41 149.04 28.17 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.352 1.061 . . . . 64.32 109.827 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -102.04 99.8 10.0 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 122.999 0.52 . . . . 74.24 109.677 176.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.448 ' HA ' HG21 ' A' ' 106' ' ' THR . 2.3 pt? -58.48 120.71 9.3 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 123.918 0.761 . . . . 73.44 109.67 174.15 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.2 mt -75.44 135.67 26.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 C-N-CA 124.438 1.095 . . . . 74.24 109.965 -170.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -67.67 115.44 7.25 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.229 1.012 . . . . 75.21 109.91 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 40.8 mm -128.99 114.69 33.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 N-CA-C 105.272 -2.121 . . . . 75.35 105.272 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -100.06 137.14 38.92 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 109.273 -0.64 . . . . 71.44 109.273 -172.544 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.2 m -92.15 120.67 32.97 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.832 0.853 . . . . 74.22 109.852 -176.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 71.1 mt -128.62 137.95 51.94 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.135 0.974 . . . . 75.33 108.819 -179.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 44.5 p -87.55 147.25 25.42 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.018 0.527 . . . . 74.11 110.084 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.5 p -109.96 165.92 11.75 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 108.796 -0.816 . . . . 70.22 108.796 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -66.42 -16.68 52.04 Favored 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.008 1.805 . . . . 71.23 111.849 169.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -79.72 135.28 36.49 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.209 1.003 . . . . 71.25 109.347 178.025 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -80.94 147.91 30.06 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.949 0.5 . . . . 73.21 109.747 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 55.44 23.91 6.26 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.575 1.15 . . . . 73.2 112.631 -178.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -128.55 121.61 29.18 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 124.742 1.217 . . . . 71.45 107.959 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.6 tp -126.93 125.46 41.58 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.677 -0.49 . . . . 74.12 109.677 -173.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -82.82 107.24 15.29 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.248 1.019 . . . . 74.12 110.462 -177.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -93.46 116.12 28.66 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.203 -1.036 . . . . 75.12 108.203 173.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 43.7 tp -102.75 125.54 49.53 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.52 0.728 . . . . 75.32 109.181 -173.823 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 p -73.71 102.56 4.0 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 107.611 -1.255 . . . . 75.2 107.611 170.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.6 m -82.44 -33.01 28.7 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.981 0.913 . . . . 75.23 111.741 -164.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -60.49 -41.14 93.65 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.337 0.655 . . . . 72.43 111.537 177.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.76 7.43 1.39 Allowed Glycine 0 C--N 1.342 0.872 0 CA-C-O 119.097 -0.835 . . . . 62.54 114.032 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -64.31 151.0 44.99 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 117.67 0.735 . . . . 75.2 109.795 175.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 17.0 ttt -125.88 131.07 52.44 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.453 -0.573 . . . . 72.51 109.453 -178.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.4 mt -95.05 -46.84 6.64 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.432 0.693 . . . . 73.42 111.462 -171.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.437 ' NE2' HG13 ' A' ' 48' ' ' ILE . 6.3 tp-100 -109.88 138.93 45.55 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.028 0.531 . . . . 72.04 110.305 175.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 29.6 m -63.63 125.31 23.87 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 124.493 1.121 . . . . 75.41 108.862 167.813 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -64.15 -22.16 66.83 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 113.478 0.918 . . . . 75.44 113.478 -164.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -92.22 21.52 37.13 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-O 119.697 -0.502 . . . . 72.1 113.547 178.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 26.0 t -132.0 167.75 19.12 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.605 0.762 . . . . 73.42 110.587 -178.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -80.17 155.62 27.34 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.055 0.942 . . . . 75.52 112.103 -174.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.2 m -67.29 107.63 2.45 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.01 0.924 . . . . 73.12 110.147 175.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.437 HG13 ' NE2' ' A' ' 41' ' ' GLN . 39.4 mt -73.85 100.67 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 109.694 -0.484 . . . . 71.04 109.694 -175.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.2 t -84.51 106.67 14.9 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 N-CA-C 107.975 -1.12 . . . . 74.33 107.975 175.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.466 HG21 ' HB3' ' A' ' 57' ' ' LEU . 54.5 mt -95.49 106.87 18.8 Favored 'Isoleucine or valine' 0 C--N 1.34 0.153 0 N-CA-C 107.828 -1.175 . . . . 73.45 107.828 -175.614 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.424 ' HE3' ' HB2' ' A' ' 54' ' ' ASP . 47.1 mtmt -91.64 135.39 33.91 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.161 -0.681 . . . . 74.11 109.161 -177.424 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.429 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 36.1 p30 -63.12 -23.58 67.51 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.169 0.587 . . . . 72.2 111.814 177.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.4 t -80.97 -13.96 58.4 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.898 0.879 . . . . 75.32 111.469 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.424 ' HB2' ' HE3' ' A' ' 51' ' ' LYS . 12.8 t0 -111.38 79.27 1.19 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.116 -1.068 . . . . 71.03 108.116 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -55.58 -32.68 63.26 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 125.627 1.571 . . . . 75.3 113.609 -169.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -62.45 -31.58 72.32 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.076 0.951 . . . . 75.15 111.928 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.466 ' HB3' HG21 ' A' ' 50' ' ' ILE . 75.4 mt -67.77 -35.46 78.74 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.846 0.858 . . . . 75.14 111.518 174.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.98 -48.72 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 108.554 -0.906 . . . . 74.32 108.554 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -54.1 -31.14 51.13 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.803 1.241 . . . . 73.23 112.726 -176.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.5 m170 -86.99 -45.67 10.55 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.059 0.543 . . . . 51.33 110.996 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.454 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 22.2 m -87.35 106.1 17.71 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.081 0.553 . . . . 74.43 111.792 -172.246 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.0 ttmm -49.61 -52.2 32.14 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 125.542 1.537 . . . . 74.32 112.726 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.583 HD11 HD12 ' A' ' 105' ' ' LEU . 33.7 tp -61.79 -36.0 79.8 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.699 -1.137 . . . . 73.22 111.451 -177.454 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.437 ' HA ' HD12 ' A' ' 77' ' ' LEU . . . -65.32 -41.3 94.14 Favored 'General case' 0 C--N 1.352 0.703 0 C-N-CA 123.236 0.614 . . . . 75.44 111.161 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' A' ' 61' ' ' SER . 78.5 mt-30 -56.21 -49.97 72.59 Favored 'General case' 0 C--N 1.352 0.684 0 O-C-N 124.143 0.902 . . . . 74.43 109.901 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.472 ' HB3' HD23 ' A' ' 104' ' ' LEU . 29.5 mm-40 -61.17 -50.75 71.87 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.305 1.042 . . . . 71.31 113.38 179.026 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 74.1 mt -66.17 -46.78 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 C-N-CA 122.839 0.456 . . . . 73.32 111.131 -174.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -70.42 -30.47 67.34 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.867 0.467 . . . . 73.04 112.054 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.9 tp -68.51 -58.79 3.78 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.75 0.42 . . . . 75.31 110.464 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.23 -19.54 56.49 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.563 -0.744 . . . . 71.23 112.015 -175.043 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.465 ' SG ' HG23 ' A' ' 97' ' ' ILE . 63.8 m -139.45 81.32 20.54 Favored Pre-proline 0 CA--C 1.554 1.127 0 N-CA-C 109.103 -0.703 . . . . 72.44 109.103 176.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.4 -6.93 16.18 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 122.988 2.459 . . . . 72.12 113.749 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -79.55 -7.37 88.54 Favored Glycine 0 C--N 1.353 1.475 0 CA-C-O 120.016 -0.325 . . . . 72.32 113.124 178.141 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 98.8 t -79.21 130.61 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 123.609 0.764 . . . . 72.4 109.225 172.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . 0.429 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 20.7 mm-40 -87.09 -46.76 9.49 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.145 0.978 . . . . 73.34 111.478 -176.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.7 p -157.88 156.53 31.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.697 -0.683 . . . . 75.04 110.838 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . 0.437 HD12 ' HA ' ' A' ' 64' ' ' ALA . 38.8 mt -108.18 167.21 10.17 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 107.931 -1.137 . . . . 73.42 107.931 171.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.59 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.9 ttm -142.8 103.89 4.26 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 106.871 -1.529 . . . . 73.35 106.871 169.64 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.484 HD12 HD11 ' A' ' 84' ' ' LEU . 28.9 mm -77.21 100.74 2.84 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 N-CA-C 107.73 -1.211 . . . . 73.34 107.73 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.15 173.02 32.63 Favored Glycine 0 C--O 1.241 0.568 0 N-CA-C 110.645 -0.982 . . . . 70.11 110.645 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -55.68 -66.61 0.39 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.901 0.881 . . . . 75.22 110.351 -173.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -105.05 -0.74 26.46 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 114.144 -1.389 . . . . 72.02 110.984 -176.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -137.7 168.16 20.24 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 122.947 0.499 . . . . 74.35 111.709 -166.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.484 HD11 HD12 ' A' ' 79' ' ' ILE . 48.9 tp -139.4 114.19 9.34 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.23 1.012 . . . . 74.23 108.71 176.301 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.59 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 31.0 m -96.13 106.63 18.84 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.481 -0.933 . . . . 74.44 108.481 -178.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.507 HG13 HD13 ' A' ' 101' ' ' ILE . 20.2 mm -87.87 117.96 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 108.103 -1.073 . . . . 74.45 108.103 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -104.58 125.7 50.96 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 107.522 -1.288 . . . . 74.42 107.522 174.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.46 169.89 16.57 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.553 0.741 . . . . 73.33 110.841 -174.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -81.37 142.51 32.96 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 115.535 -0.757 . . . . 73.13 109.263 178.792 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -80.25 0.96 30.41 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.893 0.877 . . . . 75.11 112.906 -173.559 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 23.1 ptp -78.34 -22.53 47.9 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 120.679 0.276 . . . . 73.25 110.552 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 18.9 t -102.54 147.35 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 123.743 0.817 . . . . 73.14 109.666 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -76.14 158.67 31.49 Favored 'General case' 0 CA--C 1.564 1.488 0 C-N-CA 124.1 0.96 . . . . 73.45 110.618 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 2.2 m95 -82.04 -56.03 4.2 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.703 0.801 . . . . 73.15 112.179 -179.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -60.8 -18.8 57.54 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 124.563 1.145 . . . . 72.34 112.276 -177.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 71.9 p -77.04 -39.29 50.61 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.673 0.789 . . . . 74.13 110.647 177.788 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.465 HG23 ' SG ' ' A' ' 71' ' ' CYS . 28.8 mt -79.93 -29.55 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.281 0 C-N-CA 123.631 0.772 . . . . 74.33 110.655 178.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.461 ' HZ2' ' HB3' ' A' ' 98' ' ' LYS . 6.4 ttpm? -57.74 -45.2 99.84 Favored Pre-proline 0 CA--C 1.578 2.029 0 N-CA-C 114.608 1.336 . . . . 74.21 114.608 -169.726 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -62.72 -32.81 78.28 Favored 'Trans proline' 0 C--N 1.398 3.169 0 CA-C-N 122.185 1.816 . . . . 74.41 111.557 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -63.29 -51.25 66.86 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.888 0.875 . . . . 73.55 110.019 174.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.507 HD13 HG13 ' A' ' 86' ' ' ILE . 83.2 mt -58.65 -56.05 19.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.495 0.718 . . . . 74.22 110.684 -178.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 67.4 mt -55.61 -39.57 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 C-N-CA 123.727 0.811 . . . . 74.41 111.173 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.72 -50.95 69.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.336 0.654 . . . . 75.41 111.01 178.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.472 HD23 ' HB3' ' A' ' 66' ' ' GLN . 74.4 mt -67.13 -32.7 74.0 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.11 0.964 . . . . 73.32 111.883 -176.705 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.583 HD12 HD11 ' A' ' 63' ' ' LEU . 9.5 mp -69.88 -29.17 66.32 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.683 0.793 . . . . 72.45 109.998 173.555 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.448 HG21 ' HA ' ' A' ' 16' ' ' LEU . 52.4 m -74.94 -45.51 41.93 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 109.689 -0.485 . . . . 74.3 109.689 176.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -60.04 -49.89 75.87 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.166 0.986 . . . . 74.25 110.793 -176.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.49 HE21 ' HA ' ' A' ' 115' ' ' VAL . 36.4 tt0 -53.29 -59.2 4.87 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 124.395 1.059 . . . . 73.41 111.065 177.18 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 59.7 mt -72.94 -13.5 61.26 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 114.915 -1.039 . . . . 73.15 111.691 -172.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.36 -27.76 59.29 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.98 0.912 . . . . 74.41 111.143 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -87.41 -43.95 11.71 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.076 0.55 . . . . 75.44 109.571 173.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -178.13 159.21 24.61 Favored Glycine 0 C--N 1.344 0.983 0 CA-C-N 115.544 -0.753 . . . . 51.2 112.587 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -62.08 -29.0 70.01 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.402 1.081 . . . . 75.52 112.426 -178.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -59.9 140.69 56.49 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.233 1.013 . . . . 72.22 112.626 -172.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.49 ' HA ' HE21 ' A' ' 108' ' ' GLN . 8.6 p -85.02 -43.4 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 N-CA-C 108.576 -0.898 . . . . 75.21 108.576 168.342 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 20.4 mt -143.64 96.95 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 N-CA-C 107.416 -1.328 . . . . 74.53 107.416 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.1 p -66.19 -62.54 1.42 Allowed 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.85 0.833 . . . . 74.2 108.805 172.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -137.74 8.53 2.81 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 113.72 -1.582 . . . . 75.43 107.685 158.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 . . . . . 0 CA--C 1.55 0.948 0 C-N-CA 126.441 1.897 . . . . 75.34 106.614 -169.594 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.434 ' N ' ' SD ' ' A' ' 1' ' ' MET . 3.2 mpp? . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.484 -0.562 . . . . 74.01 109.484 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 129.85 105.13 1.12 Allowed Glycine 0 C--N 1.353 1.49 0 N-CA-C 111.859 -0.497 . . . . 72.1 111.859 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -144.09 106.59 4.41 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.131 0.972 . . . . 73.23 109.318 176.238 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -74.85 124.78 27.48 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.069 0.548 . . . . 71.01 109.665 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 61.6 m80 -93.04 105.66 17.72 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 107.98 -1.119 . . . . 74.53 107.98 175.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -66.11 111.25 3.31 Favored 'General case' 0 C--O 1.243 0.745 0 O-C-N 123.765 0.666 . . . . 64.23 109.96 -176.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -61.54 124.36 20.43 Favored 'General case' 0 C--N 1.348 0.514 0 O-C-N 124.234 0.959 . . . . 72.41 108.807 174.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 21.1 m80 -84.13 166.24 17.8 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 123.837 0.855 . . . . 74.01 109.962 -173.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.1 t -61.74 126.16 26.36 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 108.939 -0.763 . . . . 74.31 108.939 172.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -72.79 78.88 1.12 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.229 0.612 . . . . 75.33 110.256 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ttt -77.38 114.77 16.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.64 -0.709 . . . . 74.44 110.264 -175.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -124.17 35.19 4.87 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.418 1.087 . . . . 64.24 109.356 179.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.4 m -78.19 4.78 11.71 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.743 -1.117 . . . . 75.02 112.443 -173.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -62.48 87.45 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.367 1.067 . . . . 74.41 110.588 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -113.6 69.83 0.71 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.41 -0.959 . . . . 72.24 108.41 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -161.37 163.76 30.44 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.353 -1.294 . . . . 71.35 109.137 175.006 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 75.8 mt -94.91 130.0 44.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 107.778 -1.193 . . . . 74.34 107.778 174.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -75.69 112.38 12.0 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.433 0.693 . . . . 72.12 109.877 -169.098 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 44.8 mm -119.97 112.23 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 107.717 -1.216 . . . . 73.12 107.717 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.504 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.2 ttmm -91.99 126.55 37.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.932 0.893 . . . . 75.35 109.514 -173.079 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.9 m -90.28 120.6 31.56 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 108.837 -0.801 . . . . 75.41 108.837 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.7 mt -128.04 139.6 52.44 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.043 0.937 . . . . 71.52 109.071 -179.232 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 72.4 p -83.68 160.94 21.22 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.166 0.586 . . . . 74.44 110.192 177.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 43.1 p -115.77 162.25 26.36 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 108.664 -0.865 . . . . 74.21 108.664 175.558 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -58.37 -16.35 28.45 Favored 'Trans proline' 0 C--N 1.377 2.027 0 C-N-CA 122.844 2.363 . . . . 74.13 113.37 167.082 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.459 ' HB3' ' HB2' ' A' ' 29' ' ' ALA . 28.0 t-20 -84.26 151.02 25.05 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.308 0.643 . . . . 64.52 110.723 176.34 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -67.04 -52.85 37.25 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 124.304 1.042 . . . . 62.13 112.594 -176.824 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -106.97 18.72 21.44 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.678 0.791 . . . . 75.42 111.253 -168.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.459 ' HB2' ' HB3' ' A' ' 26' ' ' ASN . . . -111.94 128.34 56.13 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.535 0.734 . . . . 65.21 109.272 177.15 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.9 tp -137.56 116.23 12.16 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 107.296 -1.372 . . . . 75.32 107.296 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . 0.452 ' HA ' ' HA ' ' A' ' 85' ' ' THR . 60.9 pttt -94.87 150.07 20.57 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.442 0.639 . . . . 74.14 111.194 -176.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -124.32 122.52 37.94 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.569 1.147 . . . . 60.23 108.113 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.504 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 26.7 tp -104.12 126.64 51.39 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 124.003 0.921 . . . . 72.01 109.613 -165.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.5 p -85.24 106.56 16.75 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.424 0.689 . . . . 65.33 109.142 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.6 p -96.14 -8.42 33.27 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.385 0.674 . . . . 70.31 112.66 -170.008 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.32 -32.8 37.91 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.75 0.82 . . . . 74.15 112.858 -169.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 121.41 -23.1 7.68 Favored Glycine 0 N--CA 1.475 1.248 0 N-CA-C 111.048 -0.821 . . . . 74.03 111.048 -171.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -68.06 96.76 0.64 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.456 -0.942 . . . . 75.15 108.456 168.08 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.8 ttt -79.71 139.24 37.41 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.593 0.757 . . . . 73.43 109.194 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.575 HD23 HD21 ' A' ' 109' ' ' LEU . 87.9 mt -60.1 -34.55 73.63 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.202 0.601 . . . . 70.11 112.2 -178.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . 0.544 HE22 HD13 ' A' ' 48' ' ' ILE . 25.6 tt0 -175.1 157.57 2.31 Favored 'General case' 0 C--O 1.24 0.583 0 O-C-N 124.3 1.0 . . . . 73.13 109.672 -177.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.2 t -50.11 144.85 6.47 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.61 1.164 . . . . 72.15 111.907 173.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 35.2 ptt-85 -65.35 -16.67 63.83 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.82 -1.082 . . . . 71.52 112.111 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.99 -13.76 53.77 Favored Glycine 0 C--N 1.359 1.837 0 N-CA-C 114.654 0.621 . . . . 71.24 114.654 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 76.7 p -75.06 161.61 29.28 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.325 0.65 . . . . 63.03 110.146 171.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.36 73.14 1.44 Allowed 'General case' 0 N--CA 1.488 1.46 0 CA-C-O 121.432 0.634 . . . . 74.42 111.772 -174.222 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.2 m 51.85 69.33 0.68 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.286 1.034 . . . . 75.14 111.488 -178.512 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.544 HD13 HE22 ' A' ' 41' ' ' GLN . 57.6 mt -75.85 99.21 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.587 -0.523 . . . . 65.15 109.587 -175.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 94.0 t -80.25 124.2 37.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 108.196 -1.038 . . . . 65.42 108.196 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.511 HD12 HD11 ' A' ' 116' ' ' ILE . 45.7 mt -105.02 109.37 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 108.29 -1.004 . . . . 72.44 108.29 -179.468 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -79.6 140.2 37.22 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.736 -0.468 . . . . 74.34 109.736 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -65.75 -23.83 66.82 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.784 0.433 . . . . 75.55 111.388 176.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -85.58 -19.61 30.8 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.725 0.81 . . . . 61.21 111.791 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -92.35 95.39 9.65 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 108.572 -0.899 . . . . 73.23 108.572 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -53.08 -40.15 63.85 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.369 1.068 . . . . 72.23 113.023 178.185 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -67.43 -44.15 79.43 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.514 0.726 . . . . 73.31 112.162 -169.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 97.7 mt -61.84 -35.09 77.25 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.464 0.706 . . . . 72.21 111.31 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . 0.493 HG23 ' HG2' ' A' ' 65' ' ' GLN . 53.7 mt -77.71 -34.0 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 CA-C-N 115.068 -0.969 . . . . 75.53 110.205 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -59.62 -36.44 76.32 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.181 0.592 . . . . 74.31 111.268 174.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.7 m170 -74.75 -39.23 61.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.499 0.72 . . . . 74.53 111.117 178.242 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.545 ' HB2' HD12 ' A' ' 116' ' ' ILE . 43.7 t -104.45 98.78 8.51 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.431 0.692 . . . . 73.25 110.646 -176.873 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -61.13 -32.31 72.01 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.939 0.496 . . . . 73.5 110.659 173.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.0 tp -58.27 -40.33 81.56 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.024 0.93 . . . . 75.04 110.713 174.056 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.04 -40.93 91.42 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.209 0.604 . . . . 72.52 111.544 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.493 ' HG2' HG23 ' A' ' 58' ' ' ILE . 91.9 mt-30 -55.68 -47.08 77.35 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.901 0.751 . . . . 73.33 110.162 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -62.99 -51.03 68.44 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.956 -1.02 . . . . 72.31 112.84 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -65.05 -45.83 93.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.062 0.545 . . . . 64.35 111.291 -174.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -69.37 -33.06 72.49 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.791 0.436 . . . . 74.33 112.053 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 52.8 tp -70.99 -42.69 69.32 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.709 0.404 . . . . 74.43 111.192 177.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -74.95 -26.67 59.77 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.164 0.586 . . . . 72.44 111.475 -178.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.5 t -146.88 103.58 3.88 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 122.826 0.45 . . . . 74.03 110.074 178.42 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -78.73 7.23 4.36 Favored 'Trans proline' 0 C--N 1.373 1.866 0 C-N-CA 122.757 2.305 . . . . 63.54 112.928 173.862 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -78.51 -25.76 60.39 Favored Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.149 -0.38 . . . . 72.12 112.149 171.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.486 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 42.2 t -69.43 121.96 19.97 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.186 0.594 . . . . 71.52 110.167 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -74.49 -48.33 27.89 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.252 1.021 . . . . 74.24 110.538 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 62.0 p -162.81 166.42 24.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.607 -1.178 . . . . 72.31 110.326 -173.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.2 mt -111.69 169.86 8.54 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.0 -1.111 . . . . 75.32 108.0 171.322 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.527 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 56.0 ttm -143.14 115.43 8.46 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.517 -1.29 . . . . 72.35 107.517 170.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.529 HD12 HD12 ' A' ' 84' ' ' LEU . 42.7 mm -84.89 104.64 13.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 107.943 -1.132 . . . . 75.44 107.943 179.333 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -85.46 173.31 47.75 Favored Glycine 0 C--O 1.244 0.751 0 N-CA-C 109.442 -1.463 . . . . 74.01 109.442 167.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.32 -52.39 64.88 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.224 0.61 . . . . 64.22 110.724 -176.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -123.96 5.06 8.67 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 115.368 -0.833 . . . . 75.24 111.879 -176.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -140.2 133.92 30.41 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.982 0.513 . . . . 74.1 110.379 -175.045 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.642 HD23 HD12 ' A' ' 105' ' ' LEU . 32.8 tp -103.27 114.61 29.03 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 109.445 -0.576 . . . . 75.41 109.445 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.527 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 18.4 m -97.81 113.27 25.02 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.35 0.66 . . . . 74.42 109.558 -177.429 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.577 HG13 HD11 ' A' ' 101' ' ' ILE . 30.1 mm -89.01 128.35 41.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 108.307 -0.997 . . . . 75.33 108.307 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -117.94 110.94 18.33 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 108.366 -0.976 . . . . 74.13 108.366 -177.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -117.26 174.28 6.21 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.053 0.541 . . . . 72.41 111.332 -174.467 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -74.02 131.71 41.65 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 108.511 -0.922 . . . . 72.03 108.511 172.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -56.35 -30.37 62.56 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.958 1.096 . . . . 73.3 113.958 -172.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.7 mtp -76.79 -9.33 58.6 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.98 0.512 . . . . 73.41 112.228 -176.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 39.6 t -95.77 138.62 20.86 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.323 1.049 . . . . 73.01 108.475 176.212 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -79.46 160.5 26.56 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.349 0.66 . . . . 75.34 111.165 -176.216 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 22.7 m95 -80.3 -51.87 8.38 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.115 0.566 . . . . 72.23 112.124 176.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -60.9 -18.19 55.05 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.786 0.834 . . . . 72.42 112.663 -171.753 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.9 m -71.46 -49.68 39.1 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.335 0.654 . . . . 63.13 110.717 175.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 6.7 mt -85.23 -31.1 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 CA-C-N 115.234 -0.893 . . . . 73.23 111.043 -173.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.2 ttpm? -53.66 -50.11 85.18 Favored Pre-proline 0 CA--C 1.559 1.309 0 C-N-CA 124.566 1.146 . . . . 74.43 113.993 -167.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -58.96 -35.86 97.85 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 122.014 1.81 . . . . 75.33 112.329 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.93 -37.86 82.18 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.601 -0.727 . . . . 74.11 110.668 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.577 HD11 HG13 ' A' ' 86' ' ' ILE . 69.3 mt -65.51 -54.05 32.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 123.676 0.79 . . . . 73.11 109.677 177.564 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 87.3 mt -54.32 -39.34 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 124.053 0.941 . . . . 74.42 111.317 -177.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.13 -49.1 75.74 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 115.087 -0.96 . . . . 72.15 111.3 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.0 mt -65.49 -33.46 76.0 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.75 0.82 . . . . 71.0 112.471 -178.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.642 HD12 HD23 ' A' ' 84' ' ' LEU . 9.7 mp -71.78 -27.26 62.83 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.251 0.62 . . . . 60.4 111.324 175.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.1 m -72.28 -32.47 66.65 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 109.379 -0.601 . . . . 73.13 109.379 173.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.443 ' HE2' ' HA ' ' A' ' 107' ' ' LYS . 9.1 mmpt? -69.28 -45.62 69.21 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.454 0.701 . . . . 75.42 111.105 177.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.519 HE21 ' HB ' ' A' ' 115' ' ' VAL . 1.1 tm0? -61.12 -54.24 47.02 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.902 0.881 . . . . 72.1 109.314 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . 0.575 HD21 HD23 ' A' ' 40' ' ' LEU . 97.7 mt -74.37 -14.67 60.9 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 114.729 -1.123 . . . . 74.25 112.26 -174.28 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.59 -35.81 78.89 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.993 0.517 . . . . 72.35 110.355 171.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . 0.481 ' HB2' ' HG2' ' A' ' 113' ' ' GLU . 93.0 m-85 -87.09 -34.6 19.08 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.486 -0.779 . . . . 72.41 109.713 171.29 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 79.78 52.02 4.87 Favored Glycine 0 C--N 1.349 1.292 0 N-CA-C 110.685 -0.966 . . . . 54.11 110.685 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . 0.481 ' HG2' ' HB2' ' A' ' 111' ' ' TYR . 32.5 mm-40 -82.35 154.73 25.11 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.521 0.728 . . . . 75.34 112.412 -172.301 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -89.05 98.72 11.92 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 106.202 -1.777 . . . . 73.24 106.202 159.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.523 HG13 HG12 ' A' ' 116' ' ' ILE . 3.5 p -43.58 -42.88 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 C-N-CA 125.653 1.581 . . . . 75.21 114.677 -168.556 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.545 HD12 ' HB2' ' A' ' 61' ' ' SER . 43.5 mm -96.46 -71.63 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.366 0.666 . . . . 74.53 109.984 -178.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.4 m -145.55 136.12 24.24 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.247 1.019 . . . . 71.31 109.189 -174.565 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -92.35 -39.99 11.16 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.779 0.831 . . . . 73.31 109.57 179.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.556 1.181 0 C-N-CA 123.991 0.916 . . . . 73.33 109.041 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.45 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 pmm? . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 109.527 -0.545 . . . . 70.43 109.527 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -155.63 82.05 0.16 Allowed Glycine 0 C--N 1.348 1.244 0 N-CA-C 112.175 -0.37 . . . . 73.12 112.175 -176.138 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -108.98 19.32 19.7 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.681 0.792 . . . . 75.54 110.178 175.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -63.91 129.37 39.78 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.616 1.166 . . . . 74.21 111.125 -175.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.7 m170 -77.04 141.2 40.41 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.62 0.768 . . . . 75.4 110.299 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -62.23 -52.26 64.48 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.942 0.897 . . . . 75.23 109.818 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 40.29 79.8 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 O-C-N 125.376 1.673 . . . . 73.34 112.698 170.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -85.35 27.71 0.79 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.692 1.197 . . . . 74.55 111.728 -167.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.9 p -66.99 96.27 0.42 Allowed 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 123.613 0.765 . . . . 73.05 110.428 178.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -76.8 81.43 3.4 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 108.894 -0.78 . . . . 75.2 108.894 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 18.4 ttt -75.76 106.09 7.14 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.753 -0.658 . . . . 75.45 109.976 -179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -76.95 128.0 33.73 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 108.01 -1.108 . . . . 71.43 108.01 167.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.0 m -117.18 -9.45 11.0 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.983 0.913 . . . . 72.41 110.273 177.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -77.58 171.18 15.32 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 124.361 1.064 . . . . 73.02 111.334 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 60.94 36.61 18.72 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.7 1.2 . . . . 71.41 110.613 -166.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -79.89 82.0 6.06 Favored 'General case' 0 C--N 1.356 0.849 0 CA-C-O 123.483 1.611 . . . . 74.43 108.148 169.499 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.414 ' H ' HG23 ' A' ' 106' ' ' THR . 85.6 mt -67.82 105.37 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 112.489 -2.141 . . . . 75.52 109.431 -176.547 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -67.61 127.98 34.74 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 114.591 -1.186 . . . . 74.22 109.761 -173.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.1 mm -119.95 118.71 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 106.491 -1.67 . . . . 75.22 106.491 -175.467 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -95.06 129.75 42.03 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.23 -1.026 . . . . 74.42 108.23 -175.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.6 t -100.56 130.86 46.68 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.489 0.716 . . . . 75.34 109.379 -178.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.1 mt -126.67 138.82 53.47 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.377 1.071 . . . . 74.23 108.668 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 40.1 p -73.71 149.2 42.01 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.458 0.703 . . . . 61.03 110.897 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 72.6 p -122.89 167.57 14.15 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.819 1.248 . . . . 74.55 108.028 -176.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -56.78 -18.19 26.1 Favored 'Trans proline' 0 C--N 1.39 2.735 0 C-N-CA 122.364 2.042 . . . . 71.34 113.426 177.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -109.61 133.24 53.33 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.602 0.761 . . . . 71.4 109.466 176.454 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.33 -21.76 62.88 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.283 0.633 . . . . 71.13 110.185 166.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -59.95 -47.23 86.65 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.608 1.563 . . . . 73.03 110.469 173.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.55 160.52 15.0 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 114.3 -1.318 . . . . 71.13 110.181 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.0 tp -158.18 128.55 6.17 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.787 -0.82 . . . . 75.03 108.787 173.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -82.37 127.01 32.83 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.988 0.915 . . . . 73.23 110.358 -176.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PHE . . . . . 0.442 ' CZ ' ' HG3' ' A' ' 98' ' ' LYS . 80.1 m-85 -114.75 116.71 29.09 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.562 1.145 . . . . 73.54 108.344 175.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.0 tp -114.8 129.96 56.78 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 124.069 0.948 . . . . 74.34 109.33 -169.693 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.8 t -100.02 103.87 15.43 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 108.126 -1.064 . . . . 42.35 108.126 174.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.0 p -104.24 -6.61 20.76 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.096 0.958 . . . . 73.42 109.754 176.262 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.85 -60.42 3.68 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 124.648 1.179 . . . . 70.3 111.725 -168.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -161.1 -81.54 0.04 OUTLIER Glycine 0 C--N 1.338 0.678 0 N-CA-C 111.114 -0.794 . . . . 53.23 111.114 176.748 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.21 119.91 17.08 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.471 0.708 . . . . 65.13 109.659 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 48.4 ttp -97.38 155.61 16.83 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.04 -0.982 . . . . 75.21 109.332 -176.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.1 mt -58.68 -62.29 1.97 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.115 1.154 . . . . 75.4 114.115 -169.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -114.84 -91.9 0.51 Allowed 'General case' 0 N--CA 1.484 1.235 0 CA-C-O 119.233 -0.413 . . . . 75.33 110.693 -174.086 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 10.6 t 176.44 155.65 0.23 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.504 1.122 . . . . 64.44 109.724 -177.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -71.52 150.22 45.03 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.511 0.324 . . . . 70.21 110.421 172.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 91.08 12.15 60.53 Favored Glycine 0 C--N 1.344 1.008 0 CA-C-N 116.151 -0.477 . . . . 73.41 112.447 -175.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.1 t -93.03 179.59 5.39 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.577 1.151 . . . . 75.2 110.623 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.06 -179.02 5.16 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.185 0.994 . . . . 74.54 109.635 176.19 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.8 m -74.61 93.98 2.6 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.435 0.694 . . . . 74.11 110.604 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.499 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 46.6 mt -81.44 97.07 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 N-CA-C 109.126 -0.694 . . . . 71.53 109.126 175.621 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.1 t -84.21 107.87 15.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 108.48 -0.933 . . . . 62.42 108.48 -178.278 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . 0.508 HG22 ' HB2' ' A' ' 57' ' ' LEU . 55.5 mt -105.61 109.51 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 107.138 -1.43 . . . . 75.12 107.138 174.401 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -93.48 171.62 8.79 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.507 -0.553 . . . . 71.35 109.507 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -56.75 -25.74 55.61 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.248 1.019 . . . . 75.43 112.638 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.8 t -87.12 -17.07 33.64 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.031 0.932 . . . . 73.22 111.466 -178.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -84.17 60.09 5.72 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.407 0.683 . . . . 74.14 110.43 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -61.27 -24.54 66.46 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.278 1.031 . . . . 72.54 111.577 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -56.18 -51.87 66.44 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.851 0.861 . . . . 73.11 110.218 172.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.508 ' HB2' HG22 ' A' ' 50' ' ' ILE . 21.8 mt -78.58 -34.95 46.5 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 114.312 -1.313 . . . . 74.33 110.194 -172.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 78.5 mt -62.88 -47.43 92.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.86 0.864 . . . . 73.2 110.619 176.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -66.29 -15.63 63.37 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.823 0.675 . . . . 63.05 112.823 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -87.64 -8.86 55.65 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.726 0.411 . . . . 71.55 111.955 173.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.1 t -130.39 102.18 6.07 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.579 0.752 . . . . 75.44 109.175 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -58.49 -28.37 65.33 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.106 0.562 . . . . 73.32 110.627 176.33 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.609 ' HB2' ' NE2' ' A' ' 108' ' ' GLN . 40.2 tp -62.35 -48.06 81.48 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.501 0.501 . . . . 73.45 110.358 174.549 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.81 -45.33 90.18 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 124.075 0.859 . . . . 75.11 110.075 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -57.74 -44.31 85.98 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 124.357 1.036 . . . . 74.13 111.018 178.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.414 ' HB3' HD22 ' A' ' 104' ' ' LEU . 17.8 mm100 -68.31 -36.32 79.15 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.339 0.656 . . . . 73.15 112.308 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 93.3 mt -67.77 -46.79 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.077 0.551 . . . . 72.43 109.984 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -71.4 -21.73 61.96 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 123.272 0.629 . . . . 64.21 111.694 176.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.11 -53.1 7.76 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.265 0.626 . . . . 74.45 110.491 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -84.95 -17.74 36.78 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.541 -0.754 . . . . 74.34 111.525 -174.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' CYS . . . . . 0.479 ' SG ' HG21 ' A' ' 97' ' ' ILE . 62.2 m -141.34 90.13 9.18 Favored Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 123.251 0.621 . . . . 55.31 109.602 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -75.31 -1.6 11.5 Favored 'Trans proline' 0 C--N 1.374 1.905 0 C-N-CA 122.784 2.323 . . . . 73.21 113.1 178.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.07 -22.58 77.68 Favored Glycine 0 C--N 1.351 1.388 0 N-CA-C 111.692 -0.563 . . . . 73.44 111.692 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.2 t -65.79 121.56 15.09 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 C-N-CA 123.74 0.816 . . . . 65.11 110.098 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -91.08 -40.34 11.67 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.334 1.054 . . . . 63.21 110.436 -176.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.2 t -154.18 160.52 41.91 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.595 0.712 . . . . 61.31 111.501 -175.159 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 mt -126.65 138.21 53.39 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.053 1.741 . . . . 75.24 106.803 174.07 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' MET . . . . . 0.436 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 49.9 ttm -116.66 104.63 11.57 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 108.311 -0.996 . . . . 73.23 108.311 172.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ILE . . . . . 0.723 HD12 HD13 ' A' ' 84' ' ' LEU . 10.6 mm -84.01 112.37 21.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 107.778 -1.193 . . . . 73.04 107.778 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -96.95 -158.2 31.19 Favored Glycine 0 C--O 1.242 0.627 0 N-CA-C 111.754 -0.538 . . . . 61.4 111.754 177.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.56 -62.1 1.52 Allowed 'General case' 0 C--O 1.244 0.77 0 C-N-CA 123.796 0.838 . . . . 72.24 109.301 174.904 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.87 -29.81 12.75 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 113.858 -1.519 . . . . 74.34 111.05 -174.709 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -114.64 173.19 6.59 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.275 -0.875 . . . . 72.55 113.182 -160.418 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LEU . . . . . 0.723 HD13 HD12 ' A' ' 79' ' ' ILE . 14.7 tp -144.79 117.4 8.62 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.576 1.55 . . . . 74.04 107.719 175.356 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.436 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 11.3 m -103.62 109.52 21.24 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.914 -0.773 . . . . 71.42 108.914 -175.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . 0.567 HG13 HD12 ' A' ' 101' ' ' ILE . 18.6 mm -88.46 117.28 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 108.708 -0.849 . . . . 65.44 108.708 -176.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -101.96 128.74 48.24 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 107.79 -1.189 . . . . 72.45 107.79 174.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.83 169.91 16.96 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.659 0.384 . . . . 70.33 110.389 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.18 126.81 28.62 Favored 'General case' 0 C--N 1.35 0.609 0 N-CA-C 109.236 -0.654 . . . . 64.1 109.236 178.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.6 ptm85 -65.41 -23.17 66.88 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.475 0.917 . . . . 75.52 113.475 -169.052 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.6 mmt -79.19 -21.49 46.29 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.921 0.488 . . . . 74.24 110.937 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.0 t -88.02 145.57 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 108.08 -1.082 . . . . 74.44 108.08 174.442 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -106.95 144.06 34.14 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 112.895 0.702 . . . . 73.41 112.895 -167.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -61.72 -22.99 65.84 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.543 1.137 . . . . 74.32 112.199 174.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -53.42 -32.9 51.79 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.397 1.079 . . . . 74.34 112.119 -178.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.7 t -103.45 -20.79 13.93 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.859 0.864 . . . . 74.53 111.579 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ILE . . . . . 0.479 HG21 ' SG ' ' A' ' 71' ' ' CYS . 55.5 mt -97.48 -53.65 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 122.886 0.474 . . . . 73.1 111.344 -170.259 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.442 ' HG3' ' CZ ' ' A' ' 32' ' ' PHE . 3.8 ttpm? -52.48 -47.77 92.3 Favored Pre-proline 0 N--CA 1.49 1.565 0 N-CA-C 114.026 1.121 . . . . 75.3 114.026 -173.053 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.33 -40.98 82.71 Favored 'Trans proline' 0 C--N 1.394 2.972 0 C-N-CA 122.121 1.881 . . . . 75.14 112.205 177.282 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLU . . . . . 0.438 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 11.2 mm-40 -69.58 -38.05 77.19 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 115.483 -0.781 . . . . 70.34 110.36 -177.515 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.567 HD12 HG13 ' A' ' 86' ' ' ILE . 86.2 mt -60.1 -52.28 63.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.31 0.644 . . . . 73.01 110.322 176.731 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 79.6 mt -56.91 -39.24 63.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.462 0.705 . . . . 74.13 111.026 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -64.25 -42.35 96.54 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.147 0.979 . . . . 74.23 111.33 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.491 HD21 ' HE2' ' A' ' 107' ' ' LYS . 89.6 mt -64.7 -43.67 92.74 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.497 0.719 . . . . 72.14 110.765 176.71 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' LEU . . . . . 0.604 HD12 HD13 ' A' ' 63' ' ' LEU . 11.0 mp -66.88 -24.9 66.17 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.728 0.811 . . . . 73.4 111.164 178.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.414 HG23 ' H ' ' A' ' 17' ' ' ILE . 82.9 m -77.39 -48.93 16.0 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.448 0.699 . . . . 65.52 110.42 178.439 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . 0.583 ' HZ2' ' HB3' ' A' ' 107' ' ' LYS . 0.1 OUTLIER -68.14 -40.36 82.47 Favored 'General case' 0 C--N 1.358 0.968 0 O-C-N 123.337 0.398 . . . . 74.51 110.969 -174.16 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' GLN . . . . . 0.609 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 20.7 tt0 -55.84 -58.71 6.73 Favored 'General case' 0 C--N 1.358 0.938 0 O-C-N 123.916 0.76 . . . . 71.33 110.35 177.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 86.8 mt -71.64 -10.8 60.31 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 114.841 -1.072 . . . . 72.44 111.764 -173.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.71 -37.1 70.69 Favored 'General case' 0 C--N 1.354 0.801 0 C-N-CA 123.269 0.628 . . . . 72.01 111.173 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -110.39 -19.14 13.06 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.143 0.577 . . . . 74.42 111.953 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -119.8 163.11 13.8 Favored Glycine 0 C--N 1.339 0.729 0 N-CA-C 111.016 -0.834 . . . . 63.12 111.016 -176.873 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -102.88 -24.19 13.7 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.356 0.662 . . . . 73.01 110.168 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -114.27 158.84 20.87 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.787 0.835 . . . . 75.2 111.474 -167.779 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' VAL . . . . . 0.536 HG11 HG13 ' A' ' 116' ' ' ILE . 5.8 p -83.14 -44.15 18.64 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 123.891 0.877 . . . . 74.13 111.123 174.829 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' ILE . . . . . 0.536 HG13 HG11 ' A' ' 115' ' ' VAL . 68.6 mt -112.49 -32.01 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 124.128 0.971 . . . . 75.13 110.24 -177.992 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.7 m 68.61 45.04 1.12 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.363 1.065 . . . . 74.02 109.057 -164.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -78.73 83.75 4.86 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 113.831 -1.531 . . . . 73.25 107.876 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 . . . . . 0 CA--C 1.561 1.37 0 C-N-CA 125.002 1.321 . . . . 75.04 111.783 -176.512 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.9 mt . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 107.478 -1.305 . . . . 55.53 107.478 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -64.88 124.7 22.7 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 123.75 0.656 . . . . 74.42 109.725 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.444 ' HB ' HG23 ' A' ' 102' ' ' ILE . 50.3 mm -116.03 127.37 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 N-CA-C 107.313 -1.366 . . . . 73.53 107.313 -174.188 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -93.63 150.13 20.67 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 108.494 -0.928 . . . . 71.42 108.494 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.9 t -141.28 112.23 7.22 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.695 0.798 . . . . 30.22 109.233 173.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.8 mt -99.65 138.97 35.99 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 124.075 0.95 . . . . 72.32 110.33 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.0 p -80.22 140.2 36.38 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 123.748 0.655 . . . . 72.34 109.453 176.317 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 63.9 p -107.09 166.08 11.7 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.539 1.136 . . . . 73.34 108.712 -176.676 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.71 -7.93 19.67 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.375 2.05 . . . . 75.12 112.743 169.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -82.65 151.14 26.42 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.222 1.009 . . . . 74.33 111.628 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -89.4 -31.58 17.68 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.086 0.954 . . . . 72.12 112.357 -171.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -121.82 2.3 9.99 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.269 0.627 . . . . 75.31 111.921 -174.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -112.54 137.53 50.64 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.91 0.484 . . . . 61.43 110.121 177.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.4 tp -136.99 134.59 36.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.993 0.517 . . . . 72.53 109.958 177.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.599 ' HE2' HD12 ' A' ' 33' ' ' LEU . 88.6 tttt -92.2 120.34 32.68 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.296 1.038 . . . . 72.13 110.629 -175.21 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -109.81 109.04 19.58 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.296 -1.002 . . . . 73.32 108.296 173.025 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.599 HD12 ' HE2' ' A' ' 31' ' ' LYS . 4.5 tt -111.94 134.18 53.66 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.366 -0.976 . . . . 72.33 108.366 -175.146 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.3 m -85.93 111.96 20.73 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.278 0.631 . . . . 63.25 110.006 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.523 HG23 HD22 ' A' ' 33' ' ' LEU . 26.3 p -135.21 90.94 2.68 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.838 0.855 . . . . 72.31 110.284 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -174.26 -58.59 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.168 0.587 . . . . 55.05 110.717 176.694 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.53 -72.32 0.03 OUTLIER Glycine 0 C--N 1.342 0.912 0 CA-C-N 115.695 -0.684 . . . . 63.44 111.528 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.425 ' HB2' ' HB3' ' A' ' 109' ' ' LEU . 25.0 mm-40 -99.74 167.1 10.77 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.182 0.515 . . . . 52.14 111.195 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 24.1 ptm -131.44 167.66 18.94 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.07 1.348 . . . . 71.53 108.672 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.416 HD23 HD21 ' A' ' 109' ' ' LEU . 90.2 mt -75.51 -66.69 0.74 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 122.738 0.415 . . . . 75.3 111.191 -173.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 . . . . . 0 N--CA 1.478 0.972 0 C-N-CA 123.264 0.626 . . . . 63.44 109.426 -172.018 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.3 m . . . . . 0 CA--C 1.546 0.794 0 N-CA-C 110.097 -0.334 . . . . 72.44 110.097 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 23.1 pttm -109.26 162.06 14.66 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.743 0.417 . . . . 63.22 110.712 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' A' ' 79' ' ' ILE . 17.9 p -83.37 97.01 8.71 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.393 0.677 . . . . 44.34 109.555 175.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 56.9 mt -86.06 121.2 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.919 0.888 . . . . 70.11 110.58 -174.295 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -89.5 108.65 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 N-CA-C 109.591 -0.522 . . . . 72.03 109.591 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 60.7 mt -97.16 110.2 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.915 -0.772 . . . . 71.22 108.915 -176.746 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -93.74 151.93 19.29 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.288 0.635 . . . . 71.42 110.059 -175.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.466 ' HA ' HD11 ' A' ' 58' ' ' ILE . 9.1 p30 -66.36 -22.68 66.26 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.722 0.409 . . . . 71.4 111.483 178.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.4 p -83.35 -32.81 26.05 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.578 0.751 . . . . 64.0 110.726 176.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.4 75.06 9.84 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.816 0.846 . . . . 75.42 109.513 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -64.52 -28.58 69.75 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 114.625 -1.17 . . . . 63.4 113.588 -172.038 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -60.69 -38.29 84.5 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.584 0.629 . . . . 63.21 110.814 -179.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 78.5 mt -69.78 -38.5 76.73 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.421 0.688 . . . . 74.52 110.953 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.507 HG22 ' HG2' ' A' ' 65' ' ' GLN . 52.2 mt -62.65 -46.26 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.939 0.896 . . . . 50.33 110.246 175.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -58.86 -31.41 68.52 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.645 1.178 . . . . 63.23 111.692 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -70.36 -34.29 72.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.248 0.619 . . . . 74.41 111.463 177.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.2 t -113.17 105.04 12.97 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.479 0.712 . . . . 70.2 110.154 -175.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -56.98 -31.89 65.51 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.414 0.686 . . . . 71.43 110.748 174.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.477 HD11 HD12 ' A' ' 105' ' ' LEU . 43.9 tp -63.14 -44.52 95.31 Favored 'General case' 0 C--N 1.348 0.538 0 C-N-CA 124.095 0.958 . . . . 71.44 110.535 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.71 97.06 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 123.272 0.629 . . . . 71.02 110.698 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.507 ' HG2' HG22 ' A' ' 58' ' ' ILE . 68.9 mt-30 -56.93 -44.53 82.57 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 124.355 1.035 . . . . 71.24 110.846 177.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -68.32 -36.78 79.81 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.434 0.693 . . . . 64.51 111.987 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 81.3 mt -68.72 -48.67 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.28 0.632 . . . . 64.4 111.027 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -66.97 -30.6 70.77 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.693 0.397 . . . . 72.14 111.289 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.5 tp -72.37 -52.41 16.19 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.198 0.599 . . . . 55.34 111.291 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -85.02 -29.23 25.14 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.629 0.771 . . . . 75.35 111.937 -172.891 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 58.9 m -118.98 87.35 33.73 Favored Pre-proline 0 CA--C 1.544 0.749 0 N-CA-C 107.72 -1.215 . . . . 64.12 107.72 177.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.07 -17.77 45.78 Favored 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 123.11 2.54 . . . . 75.41 113.456 -172.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.5 -12.89 83.96 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-O 119.14 -0.811 . . . . 43.41 114.364 -177.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.4 t -70.64 123.32 24.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-N 117.491 0.646 . . . . 65.42 110.7 -175.759 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -81.22 -50.78 9.16 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.693 1.197 . . . . 74.22 110.168 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 56.7 p -157.62 163.65 38.05 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 114.637 -1.165 . . . . 72.34 110.911 -173.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.4 mt -119.27 164.94 14.9 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 124.761 1.224 . . . . 71.14 108.533 177.908 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.56 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 56.0 ttm -138.33 108.43 6.4 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 107.982 -1.118 . . . . 73.23 107.982 166.067 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.75 HD13 HD13 ' A' ' 84' ' ' LEU . 23.0 mm -83.81 102.05 9.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 108.465 -0.939 . . . . 70.24 108.465 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.38 -173.69 48.43 Favored Glycine 0 C--O 1.241 0.574 0 N-CA-C 110.511 -1.036 . . . . 74.23 110.511 173.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.74 -63.49 1.05 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.159 -0.682 . . . . 71.44 109.159 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -95.57 -21.59 18.16 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.025 0.53 . . . . 64.42 111.563 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -120.13 169.68 10.01 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.738 0.644 . . . . 73.41 112.738 -168.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.75 HD13 HD13 ' A' ' 79' ' ' ILE . 18.0 tp -142.79 117.64 9.92 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.164 1.386 . . . . 62.13 107.827 176.599 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.56 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 58.4 m -96.95 109.69 22.38 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.811 -0.811 . . . . 64.32 108.811 -177.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 25.8 mm -89.33 124.13 41.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.448 -0.945 . . . . 64.0 108.448 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -109.86 127.95 55.03 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.394 -1.336 . . . . 64.3 107.394 175.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.505 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -130.8 172.29 12.17 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.79 0.436 . . . . 74.32 110.093 -176.874 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.407 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 12.5 t70 -81.44 141.94 33.42 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 109.01 -0.737 . . . . 74.15 109.01 172.29 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -66.35 -10.88 47.44 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 113.581 0.956 . . . . 72.05 113.581 -172.343 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' MET . . . . . 0.435 ' HG3' HG23 ' A' ' 92' ' ' VAL . 24.1 ptm -76.04 -28.04 57.52 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.174 0.443 . . . . 54.31 111.144 175.492 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.435 HG23 ' HG3' ' A' ' 91' ' ' MET . 40.9 t -99.1 127.29 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 109.051 -0.722 . . . . 74.41 109.051 -175.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -95.3 154.12 17.35 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.35 0.66 . . . . 73.31 111.129 -173.016 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.505 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 97.2 m95 -68.04 -13.78 62.46 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.19 0.996 . . . . 72.41 112.598 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -52.5 -35.0 52.02 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.115 0.966 . . . . 73.34 111.876 175.169 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.4 t -97.26 -32.79 11.73 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.315 0.646 . . . . 74.14 110.826 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 65.1 mt -80.55 -51.27 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 123.509 0.724 . . . . 55.23 110.857 -166.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.468 ' HG3' ' HB3' ' A' ' 94' ' ' TRP . 59.8 mtpt -54.85 -58.45 14.46 Favored Pre-proline 0 N--CA 1.484 1.246 0 CA-C-O 117.583 -1.199 . . . . 74.31 113.064 -174.034 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -59.73 -36.25 92.24 Favored 'Trans proline' 0 C--N 1.398 3.135 0 C-N-CA 121.804 1.669 . . . . 33.21 112.203 -171.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.414 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 53.5 mt-10 -64.91 -46.43 81.74 Favored 'General case' 0 C--N 1.35 0.598 0 O-C-N 123.96 0.788 . . . . 64.52 110.272 177.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.33 -32.18 49.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 123.456 0.703 . . . . 73.5 111.888 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 98' ' ' LYS . 45.0 mm -62.99 -44.0 99.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 N-CA-C 109.165 -0.68 . . . . 72.23 109.165 175.036 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.56 -50.94 70.63 Favored 'General case' 0 C--N 1.354 0.783 0 CA-C-N 114.989 -1.005 . . . . 74.34 110.421 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 96.0 mt -61.85 -39.68 92.7 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.095 0.958 . . . . 71.33 111.567 -177.039 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.477 HD12 HD11 ' A' ' 63' ' ' LEU . 7.6 mp -64.73 -37.39 87.45 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.297 0.639 . . . . 74.13 110.812 176.569 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 85.4 m -71.8 -34.09 69.08 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.812 0.445 . . . . 73.34 109.978 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -67.41 -47.49 70.13 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 123.515 0.726 . . . . 75.42 109.994 176.738 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -48.24 81.29 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 124.22 0.95 . . . . 73.33 109.995 -175.356 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.425 ' HB3' ' HB2' ' A' ' 38' ' ' GLU . 67.3 mt -68.2 -14.24 62.83 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.916 0.76 . . . . 74.34 112.19 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -89.46 -22.15 22.63 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.542 0.737 . . . . 71.2 111.379 174.388 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -90.51 -51.98 5.13 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.229 0.538 . . . . 75.15 110.554 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -142.5 146.98 18.31 Favored Glycine 0 C--N 1.343 0.954 0 CA-C-N 114.974 -1.012 . . . . 62.35 111.835 -175.707 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -77.64 -34.58 53.14 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.591 0.756 . . . . 74.15 111.026 -174.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -97.7 138.82 34.5 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.002 0.521 . . . . 62.3 109.667 170.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 CA--C 1.543 0.693 0 C-N-CA 123.781 0.832 . . . . 74.34 111.304 -178.39 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.1 mt . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 121.028 0.442 . . . . 73.4 111.608 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -95.2 145.73 24.83 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.674 0.79 . . . . 73.13 109.018 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.0 mm -129.03 126.78 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 106.75 -1.574 . . . . 74.45 106.75 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -105.75 125.73 51.33 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.311 -0.996 . . . . 51.41 108.311 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.9 t -102.57 113.15 26.27 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 109.101 -0.704 . . . . 61.11 109.101 -177.594 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.8 mt -101.3 140.55 35.44 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.579 0.752 . . . . 44.12 110.321 177.496 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 28.0 p -85.34 157.69 20.47 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.005 0.522 . . . . 74.44 111.211 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.3 p -126.72 161.48 52.86 Favored Pre-proline 0 CA--C 1.558 1.283 0 C-N-CA 124.762 1.225 . . . . 65.43 108.305 -177.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -61.53 -17.92 56.74 Favored 'Trans proline' 0 C--N 1.383 2.364 0 C-N-CA 122.23 1.953 . . . . 62.04 113.526 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -101.29 132.41 46.83 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 108.684 -0.858 . . . . 61.22 108.684 175.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.09 -16.6 56.52 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.563 0.345 . . . . 61.14 111.918 -176.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -70.6 -38.75 74.04 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 109.41 -0.589 . . . . 72.03 109.41 175.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.48 144.62 26.63 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.499 0.72 . . . . 74.12 110.67 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.5 tp -154.94 124.29 6.38 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.211 -0.663 . . . . 74.01 109.211 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -83.63 121.37 27.16 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.766 0.826 . . . . 63.24 110.837 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -109.4 112.73 25.02 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.299 1.04 . . . . 74.42 108.468 168.733 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.2 tp -105.01 134.48 48.04 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.27 1.028 . . . . 55.02 109.352 -176.28 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.4 p -74.91 105.25 5.85 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 108.54 -0.911 . . . . 71.14 108.54 172.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.6 m -107.97 39.97 1.84 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.473 1.109 . . . . 74.21 110.025 -168.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -137.16 -156.14 0.67 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.043 -0.98 . . . . 63.14 108.548 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -72.87 -20.62 79.91 Favored Glycine 0 C--N 1.352 1.423 0 CA-C-N 118.295 0.498 . . . . 70.41 113.352 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -94.76 158.7 15.39 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 121.31 0.576 . . . . 55.3 111.633 -176.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.5 ttt -134.25 150.97 51.06 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.604 1.162 . . . . 74.15 109.128 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.546 ' O ' ' HB3' ' A' ' 114' ' ' ASP . 94.1 mt -78.77 -58.07 3.43 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.86 0.689 . . . . 63.12 112.86 -175.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 . . . . . 0 N--CA 1.48 1.07 0 O-C-N 121.591 -0.693 . . . . 72.34 109.731 -177.352 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.4 t . . . . . 0 CA--C 1.548 0.876 0 N-CA-C 109.822 -0.436 . . . . 74.12 109.822 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -93.35 142.59 27.15 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.073 0.949 . . . . 52.34 108.669 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.4 m -79.36 83.28 5.41 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 108.726 -0.842 . . . . 71.4 108.726 172.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 52.5 mt -73.93 99.58 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 CA-C-N 115.536 -0.756 . . . . 71.54 109.956 -170.554 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 77' ' ' LEU . 40.0 t -96.31 107.61 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 108.907 -0.775 . . . . 72.04 108.907 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.42 HG23 ' HB2' ' A' ' 57' ' ' LEU . 71.9 mt -105.18 113.46 42.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.436 1.094 . . . . 64.54 108.401 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.6 mtmp? -80.2 161.53 25.15 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 108.862 -0.792 . . . . 72.41 108.862 176.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -64.09 -18.38 64.34 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.668 0.787 . . . . 74.31 111.935 178.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 74.1 p -74.9 -27.77 60.36 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.52 1.128 . . . . 65.4 112.08 175.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.89 69.35 10.55 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.792 0.837 . . . . 61.14 111.225 -172.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -60.12 -29.62 68.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.416 0.686 . . . . 74.23 111.609 -177.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -58.3 -48.46 80.44 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.684 1.194 . . . . 70.44 110.932 175.595 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.42 ' HB2' HG23 ' A' ' 50' ' ' ILE . 89.8 mt -79.05 -29.97 43.8 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 115.517 -0.765 . . . . 72.24 111.227 -177.576 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 93.5 mt -65.84 -43.48 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.874 0.869 . . . . 71.25 109.859 176.184 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.432 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 90.2 m-20 -69.96 -7.72 43.02 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.882 0.697 . . . . 62.52 112.882 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -91.89 -6.12 52.03 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 122.873 0.469 . . . . 73.43 110.946 174.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.3 p -140.2 104.78 4.89 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 123.748 0.819 . . . . 70.45 109.596 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 38.6 ttpt -56.69 -29.37 62.3 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.898 0.479 . . . . 74.11 111.461 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.525 HD11 HD12 ' A' ' 105' ' ' LEU . 25.5 tp -59.19 -46.62 87.95 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 123.292 0.637 . . . . 64.51 110.522 178.414 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.53 -47.16 86.61 Favored 'General case' 0 C--N 1.348 0.5 0 O-C-N 124.242 0.964 . . . . 73.24 110.375 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.432 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 97.6 mt-30 -54.4 -46.74 73.2 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.461 1.101 . . . . 75.55 111.57 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 15.0 mm100 -73.58 -35.26 65.42 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 116.043 -0.526 . . . . 74.3 112.027 -177.785 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 65.8 mt -65.45 -46.47 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 122.983 0.513 . . . . 74.42 110.319 177.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -70.08 -28.7 65.64 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.054 0.542 . . . . 73.04 111.71 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.5 tp -69.63 -55.99 8.52 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.727 0.411 . . . . 75.15 110.278 175.766 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.452 HE22 HD21 ' A' ' 104' ' ' LEU . 78.1 mt-30 -70.6 -26.81 63.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.367 -0.833 . . . . 41.24 110.949 -175.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.717 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 77.6 m -144.25 91.91 6.29 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 123.334 0.654 . . . . 54.44 109.932 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.58 3.01 5.18 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 122.97 2.447 . . . . 50.11 113.691 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -94.26 22.49 36.58 Favored Glycine 0 C--N 1.347 1.16 0 C-N-CA 122.82 0.248 . . . . 60.43 113.244 175.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.428 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 60.5 t -98.75 132.24 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.494 0.718 . . . . 72.53 109.707 172.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -88.61 -48.17 7.75 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.124 0.969 . . . . 71.23 112.602 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 53.9 p -159.25 163.24 36.02 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.859 0.464 . . . . 73.32 111.509 -177.158 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 49' ' ' VAL . 42.3 mt -124.88 125.59 44.21 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 107.983 -1.117 . . . . 63.12 107.983 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.499 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.9 ttm -105.47 112.68 25.86 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 107.657 -1.238 . . . . 63.41 107.657 174.826 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.509 HD12 HG21 ' A' ' 115' ' ' VAL . 18.9 mm -86.71 113.5 24.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.548 0 N-CA-C 107.956 -1.127 . . . . 74.44 107.956 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -84.12 -171.45 47.9 Favored Glycine 0 C--O 1.243 0.663 0 N-CA-C 111.373 -0.691 . . . . 65.14 111.373 174.633 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -70.12 -60.57 2.21 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.381 -0.599 . . . . 72.44 109.381 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -96.67 -37.09 10.47 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.587 1.155 . . . . 74.33 109.989 178.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -102.92 175.87 5.34 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.512 -1.222 . . . . 75.11 112.529 -165.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.406 HD21 HD11 ' A' ' 86' ' ' ILE . 29.2 tp -129.57 146.6 51.37 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 106.69 -1.596 . . . . 54.01 106.69 173.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.499 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 89.9 m -130.01 110.1 11.38 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.476 -0.935 . . . . 61.13 108.476 174.399 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.549 HG13 HD13 ' A' ' 101' ' ' ILE . 22.5 mm -88.56 118.18 33.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 108.653 -0.869 . . . . 51.3 108.653 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -96.28 116.92 29.79 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 107.9 -1.148 . . . . 65.11 107.9 172.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 19.5 pttp -104.58 175.02 5.63 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.527 0.731 . . . . 71.54 109.354 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -74.74 137.52 42.09 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.154 -0.93 . . . . 75.3 108.732 168.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -36.38 74.53 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.21 1.404 . . . . 74.31 113.002 -176.487 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 66.3 mtt -83.83 -15.17 49.28 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.565 0.746 . . . . 61.33 111.431 -177.713 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.9 t -88.33 144.76 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 109.323 -0.621 . . . . 74.22 109.323 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -105.11 144.56 31.74 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.101 0.961 . . . . 74.14 110.556 -171.526 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 53.1 m95 -66.98 -23.79 65.98 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 114.069 1.137 . . . . 73.11 114.069 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -61.48 -21.34 64.1 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.123 0.569 . . . . 64.54 112.0 -172.642 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -92.88 -33.78 14.08 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.393 0.677 . . . . 71.11 111.71 174.989 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.717 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 34.6 mt -83.44 -47.29 18.21 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 C-N-CA 123.245 0.618 . . . . 63.42 111.315 -166.503 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -53.83 -53.23 60.13 Favored Pre-proline 0 N--CA 1.486 1.355 0 CA-C-O 117.651 -1.166 . . . . 54.3 114.015 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -56.87 -37.93 97.07 Favored 'Trans proline' 0 C--N 1.399 3.231 0 C-N-CA 122.142 1.895 . . . . 73.15 111.701 -176.477 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -61.45 -53.78 52.09 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.033 -0.985 . . . . 40.24 110.396 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.549 HD13 HG13 ' A' ' 86' ' ' ILE . 65.0 mt -61.42 -51.94 67.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.904 0 O-C-N 124.132 0.895 . . . . 75.21 111.917 -178.188 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 98.0 mt -56.45 -43.61 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 123.757 0.823 . . . . 74.22 111.483 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.25 -48.99 79.57 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.906 0.754 . . . . 51.54 110.067 177.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.452 HD21 HE22 ' A' ' 70' ' ' GLN . 84.3 mt -58.39 -44.54 88.97 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 114.656 -1.157 . . . . 72.42 112.087 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.525 HD12 HD11 ' A' ' 63' ' ' LEU . 10.2 mp -65.84 -33.66 76.35 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.571 0.748 . . . . 62.4 111.755 -178.188 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 60.9 m -75.84 -34.68 60.08 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.219 0.608 . . . . 61.45 110.383 -176.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -75.19 -48.55 23.02 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.077 0.551 . . . . 73.44 110.177 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -51.18 -59.9 3.69 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 125.586 1.554 . . . . 75.35 112.483 -176.006 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.4 mt -63.41 -26.88 68.94 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.761 -1.108 . . . . 73.43 110.97 -177.618 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.98 -10.12 59.35 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.917 0.887 . . . . 65.24 112.268 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -81.46 -15.18 55.81 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 122.61 0.364 . . . . 65.34 110.764 169.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 113.88 -28.7 8.27 Favored Glycine 0 C--N 1.346 1.119 0 CA-C-N 116.135 -0.484 . . . . 42.23 112.101 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -90.42 178.67 6.06 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.621 0.769 . . . . 51.42 112.724 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.546 ' HB3' ' O ' ' A' ' 40' ' ' LEU . 6.2 m-20 -110.23 -170.64 1.68 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.424 -1.262 . . . . 54.33 111.453 -170.237 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.509 HG21 HD12 ' A' ' 79' ' ' ILE . 7.2 p . . . . . 0 N--CA 1.48 1.045 0 C-N-CA 124.316 1.047 . . . . 64.12 112.196 178.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.3 mm . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 109.161 -0.681 . . . . 75.12 109.161 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 59.2 m80 -74.04 116.01 14.18 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.484 1.114 . . . . 60.32 110.196 -177.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.8 mm -122.98 114.46 42.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.827 0 N-CA-C 107.697 -1.223 . . . . 62.1 107.697 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 40.7 ttmt -98.94 131.35 45.07 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.473 0.709 . . . . 71.21 109.992 -177.2 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.7 m -93.55 114.01 26.26 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.969 -0.752 . . . . 74.45 108.969 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.3 mt -121.14 137.61 54.59 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.859 0.864 . . . . 72.02 110.141 -175.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.2 p -85.73 153.83 22.05 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.876 0.87 . . . . 54.41 111.09 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.418 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 47.7 p -121.51 175.67 2.35 Favored Pre-proline 0 CA--C 1.56 1.35 0 N-CA-C 107.715 -1.217 . . . . 75.21 107.715 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.418 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 62.6 Cg_endo -71.76 2.76 4.36 Favored 'Trans proline' 0 C--N 1.377 2.057 0 C-N-CA 121.886 1.724 . . . . 72.54 113.061 167.42 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.562 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 91.2 m-20 -108.3 135.7 49.17 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.212 1.005 . . . . 75.11 111.501 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -72.02 -25.37 61.79 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.207 1.003 . . . . 73.43 111.623 174.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 87' ' ' ASN . 86.7 m-20 -112.02 29.94 7.46 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.021 0.928 . . . . 52.4 110.553 -176.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.562 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -142.01 124.73 15.95 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.177 0.591 . . . . 40.4 109.634 172.341 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.1 tp -135.02 121.43 20.42 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 108.609 -0.885 . . . . 74.52 108.609 178.488 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.532 ' HE2' HD13 ' A' ' 33' ' ' LEU . 87.8 tttt -87.61 119.43 27.91 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.181 0.992 . . . . 71.12 111.116 -175.155 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -103.8 111.21 23.63 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 107.818 -1.178 . . . . 71.41 107.818 173.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.532 HD13 ' HE2' ' A' ' 31' ' ' LYS . 37.8 tp -104.35 128.16 52.13 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 124.382 1.073 . . . . 61.21 110.185 -167.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 28.4 m -70.76 105.69 3.29 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.753 -1.202 . . . . 73.4 107.753 170.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.0 m -86.87 -15.53 38.78 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.858 0.463 . . . . 52.34 111.754 -168.466 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.58 -64.3 1.1 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.531 0.733 . . . . 75.33 111.201 -178.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.418 ' O ' ' HG3' ' A' ' 39' ' ' MET . . . 156.08 -7.4 0.25 Allowed Glycine 0 C--N 1.341 0.847 0 CA-C-O 119.392 -0.671 . . . . 74.33 113.302 -174.281 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 109' ' ' LEU . 1.0 OUTLIER -71.07 104.72 3.11 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 108.158 -1.053 . . . . 73.31 108.158 168.638 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.418 ' HG3' ' O ' ' A' ' 37' ' ' GLY . 87.9 mtp -103.3 151.04 23.17 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.652 0.781 . . . . 74.42 110.605 -170.277 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.7 mt -71.4 -36.4 71.37 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.885 0.874 . . . . 63.23 112.008 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 . . . . . 0 N--CA 1.485 1.325 0 C-N-CA 123.515 0.726 . . . . 74.11 109.644 -179.706 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 41.4 t . . . . . 0 N--CA 1.473 0.716 0 CA-C-O 120.88 0.371 . . . . 72.4 111.0 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -70.35 158.25 36.28 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 115.16 -0.927 . . . . 71.31 110.52 173.763 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.3 m -78.67 89.15 4.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.372 0.669 . . . . 70.22 109.431 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.635 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 42.8 mt -77.21 100.42 2.71 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 108.852 -0.795 . . . . 71.33 108.852 -177.358 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.1 t -90.33 109.8 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.549 0.74 . . . . 64.33 109.267 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 81.4 mt -118.73 111.06 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.39 1.076 . . . . 63.54 108.575 -178.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.525 ' HG2' ' HB3' ' A' ' 76' ' ' SER . 94.9 mttt -88.03 159.36 18.3 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 109.666 -0.494 . . . . 74.01 109.666 176.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -64.83 -20.93 66.66 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.918 0.487 . . . . 73.53 110.934 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 22.9 p -78.61 -31.23 46.96 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.124 0.97 . . . . 70.2 110.985 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -76.48 74.31 3.22 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.584 0.754 . . . . 51.3 110.128 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -55.88 -43.53 77.26 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.926 0.89 . . . . 64.34 111.742 -175.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -55.59 -48.31 75.05 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.09 0.956 . . . . 74.43 110.907 -177.484 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.3 mt -62.39 -36.05 81.09 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.102 -0.954 . . . . 71.14 111.052 -178.437 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 54.0 mt -73.51 -45.27 52.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 123.183 0.593 . . . . 52.41 110.311 -177.855 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -54.12 -30.87 50.49 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.422 1.089 . . . . 73.5 111.791 -178.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 64.1 m80 -87.81 -44.66 10.95 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.666 0.787 . . . . 71.13 110.703 175.833 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.5 m -79.04 98.76 6.6 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.056 0.455 . . . . 73.4 111.376 -176.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.409 ' HE3' HE22 ' A' ' 108' ' ' GLN . 31.6 ttpt -46.55 -53.08 12.07 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.716 1.607 . . . . 73.42 113.63 178.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.451 ' HB3' HG23 ' A' ' 115' ' ' VAL . 30.5 tp -65.3 -34.85 79.31 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.976 0.51 . . . . 75.35 111.722 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.15 -40.95 97.7 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 122.329 0.252 . . . . 74.41 110.527 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -56.07 -50.34 71.27 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.013 0.821 . . . . 75.42 110.305 176.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -60.83 -48.81 80.09 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.059 0.943 . . . . 74.01 113.127 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.3 -51.16 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 C-N-CA 123.403 0.681 . . . . 53.12 111.293 -175.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -67.23 -33.63 75.75 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.046 0.538 . . . . 74.15 111.193 -179.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.6 tp -59.81 -53.69 54.93 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.499 0.72 . . . . 74.04 110.794 176.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.504 ' NE2' HD21 ' A' ' 104' ' ' LEU . 74.1 mt-30 -77.45 -24.55 50.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 114.978 -1.01 . . . . 74.32 112.498 -175.044 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.564 ' SG ' HG23 ' A' ' 97' ' ' ILE . 72.7 m -144.84 96.91 4.99 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 109.35 -0.611 . . . . 72.11 109.35 -178.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.4 0.27 10.08 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 122.827 2.352 . . . . 73.12 113.132 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -84.68 -0.54 89.22 Favored Glycine 0 C--N 1.353 1.503 0 CA-C-O 119.89 -0.394 . . . . 74.23 113.023 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.0 t -82.22 123.76 38.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.237 0.615 . . . . 52.54 109.599 176.244 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -77.79 -55.0 5.69 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.932 0.893 . . . . 75.41 110.601 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.525 ' HB3' ' HG2' ' A' ' 51' ' ' LYS . 27.7 p -150.14 164.03 36.67 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.577 0.703 . . . . 74.41 111.459 -175.003 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 78.6 mt -122.57 128.66 51.02 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.427 1.091 . . . . 73.42 108.265 178.079 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.538 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.4 ttm -102.25 99.12 9.19 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 106.741 -1.577 . . . . 75.41 106.741 169.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.635 ' HB ' ' HB ' ' A' ' 48' ' ' ILE . 29.1 mm -80.87 125.22 39.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.24 -1.022 . . . . 72.3 108.24 -177.836 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.52 -173.18 20.8 Favored Glycine 0 C--O 1.242 0.6 0 N-CA-C 111.539 -0.625 . . . . 73.31 111.539 172.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -80.06 -58.18 3.28 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 122.807 0.443 . . . . 71.24 110.453 176.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -113.79 18.51 17.35 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 122.877 0.471 . . . . 71.41 110.92 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -148.5 163.61 36.66 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 122.755 0.422 . . . . 73.14 110.944 -177.232 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 51.8 tp -144.94 107.05 4.32 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.472 0.709 . . . . 74.22 109.243 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.538 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 28.0 m -96.95 106.74 19.13 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.299 -1.0 . . . . 75.13 108.299 -179.097 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.653 HG13 HD13 ' A' ' 101' ' ' ILE . 21.8 mm -87.47 141.53 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.518 0.727 . . . . 51.14 109.291 -175.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.455 ' HA ' ' O ' ' A' ' 28' ' ' ASN . 24.2 m-80 -120.82 120.63 36.13 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.802 0.841 . . . . 74.51 109.06 176.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.409 ' HD3' ' HB ' ' A' ' 92' ' ' VAL . 0.1 OUTLIER -122.01 165.94 15.25 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.719 0.808 . . . . 70.54 110.191 179.353 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -68.0 141.45 56.24 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.696 0.798 . . . . 62.3 109.382 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ARG . . . . . 0.444 ' HB3' HD21 ' A' ' 28' ' ' ASN . 2.2 ptm180 -68.63 -10.98 59.43 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 112.855 0.687 . . . . 73.53 112.855 -171.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.3 ptp -77.95 -16.13 58.42 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.011 0.525 . . . . 71.35 111.133 174.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.542 HG11 HD11 ' A' ' 97' ' ' ILE . 34.4 t -93.54 141.98 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.148 0.979 . . . . 75.25 110.262 -176.697 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -95.17 136.23 35.77 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.922 0.889 . . . . 65.25 108.881 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 44.9 m95 -58.66 -43.55 89.89 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.611 0.967 . . . . 74.51 113.611 -174.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -57.82 -18.58 22.96 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.469 0.707 . . . . 63.14 112.717 -174.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.4 m -69.21 -54.27 15.63 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 121.386 0.613 . . . . 73.1 110.628 174.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.564 HG23 ' SG ' ' A' ' 71' ' ' CYS . 16.4 mt -83.96 -32.97 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 123.913 0.885 . . . . 75.3 110.858 -171.75 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -50.35 -56.08 20.95 Favored Pre-proline 0 CA--C 1.567 1.611 0 C-N-CA 125.038 1.335 . . . . 72.41 114.219 -172.134 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.58 -27.59 38.82 Favored 'Trans proline' 0 C--N 1.393 2.869 0 C-N-CA 121.8 1.666 . . . . 53.23 111.961 -176.305 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -67.78 -43.38 79.92 Favored 'General case' 0 C--N 1.349 0.568 0 C-N-CA 123.517 0.727 . . . . 71.33 109.746 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.653 HD13 HG13 ' A' ' 86' ' ' ILE . 95.6 mt -60.01 -51.16 76.15 Favored 'Isoleucine or valine' 0 C--N 1.359 0.998 0 C-N-CA 123.865 0.866 . . . . 71.02 109.784 176.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 74.0 mt -56.47 -41.04 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.522 0.729 . . . . 74.33 110.797 -178.095 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.75 -46.8 77.47 Favored 'General case' 0 CA--C 1.549 0.939 0 O-C-N 123.694 0.621 . . . . 55.11 110.933 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.504 HD21 ' NE2' ' A' ' 70' ' ' GLN . 99.0 mt -63.97 -35.07 79.48 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.958 0.903 . . . . 71.42 111.852 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 101' ' ' ILE . 8.6 mp -72.93 -23.72 60.72 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.83 0.852 . . . . 61.24 110.793 177.118 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 64.3 m -77.41 -36.59 53.17 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 109.183 -0.673 . . . . 75.02 109.183 174.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -66.42 -39.29 88.88 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.341 0.656 . . . . 73.01 110.296 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.409 HE22 ' HE3' ' A' ' 62' ' ' LYS . 11.7 mm100 -60.19 -63.68 1.22 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.561 0.745 . . . . 73.45 110.714 176.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 38' ' ' GLU . 74.2 mt -78.55 -2.83 40.7 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 114.854 -1.066 . . . . 74.23 112.377 -167.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -89.71 -49.03 6.88 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.531 0.732 . . . . 73.35 111.266 171.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -88.88 -52.35 5.15 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 116.129 -0.487 . . . . 72.14 110.78 -171.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -158.67 103.57 0.23 Allowed Glycine 0 C--N 1.342 0.884 0 N-CA-C 109.867 -1.293 . . . . 61.33 109.867 -175.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.99 -24.95 64.87 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.908 1.283 . . . . 72.51 112.778 -164.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -68.05 118.28 11.01 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 123.688 0.618 . . . . 73.34 109.96 -176.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.527 HG11 HG21 ' A' ' 79' ' ' ILE . 3.5 p . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 125.625 1.57 . . . . 75.41 112.74 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.421 ' HB ' HG23 ' A' ' 106' ' ' THR . 77.0 mt . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 108.067 -1.086 . . . . 65.41 108.067 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.469 ' HB3' ' HB3' ' A' ' 36' ' ' ASP . 62.7 t60 -69.23 122.14 18.23 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 113.829 -1.532 . . . . 72.35 111.707 -170.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 47.9 mm -126.34 125.55 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 107.239 -1.393 . . . . 70.11 107.239 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.416 ' HE2' HD23 ' A' ' 33' ' ' LEU . 38.8 ttpt -99.13 126.13 44.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.069 0.548 . . . . 65.4 109.541 -178.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 35.0 m -92.0 117.21 29.6 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.276 0.63 . . . . 73.43 109.382 -177.092 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.6 mt -115.11 138.47 50.86 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.179 0.991 . . . . 52.45 109.407 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 54.9 p -85.13 153.27 22.79 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.297 0.639 . . . . 71.31 110.568 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.402 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 71.7 p -119.52 172.73 4.14 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 124.291 1.037 . . . . 75.34 109.064 -174.444 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.402 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 86.4 Cg_endo -75.17 14.86 0.83 Allowed 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 122.185 1.923 . . . . 73.55 113.215 167.764 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.422 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 11.1 m120 -118.95 157.16 28.26 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 124.167 0.987 . . . . 51.14 109.361 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.76 -32.93 10.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.276 0.631 . . . . 62.13 109.931 175.096 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -71.6 -40.63 69.71 Favored 'General case' 0 C--O 1.215 -0.759 0 C-N-CA 123.0 0.52 . . . . 73.5 110.153 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.422 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -93.09 141.22 28.66 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.075 0.55 . . . . 62.35 111.487 -175.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.8 tp -140.49 133.2 28.9 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 108.455 -0.943 . . . . 65.3 108.455 172.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -93.25 131.52 38.29 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.824 0.85 . . . . 65.41 110.672 -173.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -120.17 121.02 37.84 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.826 1.25 . . . . 75.11 107.996 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.416 HD23 ' HE2' ' A' ' 20' ' ' LYS . 47.3 tp -106.77 128.8 54.54 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.567 0.747 . . . . 71.42 110.488 -171.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.2 m -73.91 106.09 5.46 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.319 -0.993 . . . . 64.22 108.319 171.134 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.4 m -105.85 -32.19 8.48 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.024 0.53 . . . . 63.24 111.797 -163.61 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.469 ' HB3' ' HB3' ' A' ' 18' ' ' HIS . 5.8 p-10 -82.55 -162.55 0.59 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.273 0.229 . . . . 53.11 110.593 178.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.69 -16.67 63.8 Favored Glycine 0 C--N 1.355 1.589 0 N-CA-C 114.323 0.489 . . . . 51.24 114.323 -177.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -86.21 147.31 26.17 Favored 'General case' 0 C--N 1.352 0.688 0 CA-C-N 117.82 0.81 . . . . 54.23 110.266 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 25.4 ttt -147.05 130.64 16.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 107.638 -1.245 . . . . 70.12 107.638 -173.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.424 ' O ' ' HA ' ' A' ' 114' ' ' ASP . 64.1 mt -54.15 -45.94 72.14 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.87 0.868 . . . . 23.23 112.176 -171.126 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.558 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 5.4 tt0 . . . . . 0 CA--C 1.544 0.72 0 C-N-CA 125.117 1.367 . . . . 65.33 108.757 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 0 N--CA 1.476 0.874 0 CA-C-O 120.991 0.424 . . . . 70.04 110.839 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -97.36 -174.37 2.91 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.845 1.258 . . . . 74.34 110.925 -174.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' SER . . . . . 0.4 ' HA ' ' O ' ' A' ' 79' ' ' ILE . 28.0 p -76.82 88.02 3.42 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.235 0.614 . . . . 73.14 110.1 175.189 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.7 mt -76.8 127.61 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.803 0.841 . . . . 74.24 110.828 -177.189 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 95.6 t -89.79 123.81 42.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 N-CA-C 109.127 -0.694 . . . . 62.13 109.127 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.433 HG12 ' HB3' ' A' ' 57' ' ' LEU . 54.5 mt -116.02 110.11 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 108.283 -1.006 . . . . 62.04 108.283 174.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -90.87 164.79 13.92 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 109.203 -0.666 . . . . 74.12 109.203 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -57.44 -27.35 62.36 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 124.168 0.918 . . . . 74.04 112.292 175.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.5 p -75.31 -33.76 61.2 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.64 0.776 . . . . 73.51 111.86 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.414 ' O ' HG13 ' A' ' 58' ' ' ILE . 3.9 m-20 -78.86 74.23 5.39 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.431 0.692 . . . . 53.35 111.164 -170.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -50.49 -42.38 54.6 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.977 1.311 . . . . 73.04 111.565 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -58.37 -49.25 77.91 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.752 0.821 . . . . 74.34 111.476 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.433 ' HB3' HG12 ' A' ' 50' ' ' ILE . 80.4 mt -70.49 -38.82 74.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.538 0.735 . . . . 63.43 111.362 -175.596 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 54' ' ' ASP . 81.4 mt -57.76 -48.13 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.02 0.928 . . . . 75.44 109.443 175.078 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -66.64 -26.05 66.88 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.355 0.872 . . . . 62.31 113.355 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -70.52 -36.57 73.83 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.536 0.334 . . . . 73.24 111.383 178.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.5 p -116.62 105.72 12.75 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.518 0.727 . . . . 72.42 109.552 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -62.77 -19.94 64.48 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.993 0.517 . . . . 71.33 111.427 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.575 HD11 HD12 ' A' ' 105' ' ' LEU . 48.7 tp -60.04 -46.98 87.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.366 0.666 . . . . 71.52 110.1 170.466 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.13 -41.81 99.38 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.242 0.617 . . . . 64.23 110.745 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -56.4 -48.6 76.59 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 123.861 0.726 . . . . 74.32 110.883 175.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -60.51 -44.56 95.88 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.86 0.864 . . . . 63.32 112.79 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.517 HG22 HG21 ' A' ' 74' ' ' VAL . 97.1 mt -66.54 -46.41 86.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 123.35 0.66 . . . . 75.1 110.605 -177.215 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -68.95 -37.07 78.63 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.799 0.44 . . . . 75.34 111.779 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.2 tp -66.82 -53.83 28.73 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.526 0.73 . . . . 73.3 110.604 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -81.0 -24.05 38.25 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 114.941 -1.027 . . . . 70.14 111.666 -173.231 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 38.2 m -126.37 97.15 34.72 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 109.487 -0.56 . . . . 75.03 109.487 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.11 -17.34 45.59 Favored 'Trans proline' 0 C--N 1.378 2.093 0 C-N-CA 123.59 2.86 . . . . 64.25 113.879 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -89.96 13.59 64.21 Favored Glycine 0 C--N 1.346 1.11 0 CA-C-O 119.69 -0.505 . . . . 53.24 113.576 -177.246 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.517 HG21 HG22 ' A' ' 67' ' ' ILE . 41.6 t -85.69 122.4 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.732 -0.84 . . . . 72.02 108.732 173.623 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -90.06 -40.49 12.26 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.509 0.724 . . . . 74.03 110.085 -177.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.9 p -160.1 170.85 20.38 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.486 -0.779 . . . . 51.03 110.832 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 85.4 mt -131.61 150.52 52.12 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.045 1.338 . . . . 72.04 108.516 177.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.414 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 57.6 ttm -123.85 102.56 7.86 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 107.255 -1.387 . . . . 75.22 107.255 167.993 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 47' ' ' SER . 15.3 mm -82.5 120.45 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 115.552 -0.749 . . . . 73.54 109.176 -177.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.06 -179.7 21.28 Favored Glycine 0 C--O 1.242 0.642 0 N-CA-C 111.41 -0.676 . . . . 64.34 111.41 172.558 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.558 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 4.5 p-10 -72.33 -53.8 11.32 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.294 0.638 . . . . 53.14 110.774 178.363 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 0.4 ' O ' HD12 ' A' ' 33' ' ' LEU . 14.0 p-10 -116.58 -0.3 12.47 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.755 -0.591 . . . . 72.42 111.435 177.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -126.52 156.24 41.09 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.754 -0.462 . . . . 72.31 109.754 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.549 HD23 HD11 ' A' ' 105' ' ' LEU . 39.5 tp -144.84 119.69 9.92 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.216 -0.661 . . . . 72.1 109.216 176.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 32.9 m -107.59 108.35 19.59 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 109.415 -0.587 . . . . 75.3 109.415 -177.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.511 ' HB ' ' HH2' ' A' ' 94' ' ' TRP . 21.1 mm -89.66 141.48 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 N-CA-C 108.259 -1.015 . . . . 74.34 108.259 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -114.31 119.67 37.76 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.601 -0.518 . . . . 75.01 109.601 179.047 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.676 ' HZ2' HD13 ' A' ' 97' ' ' ILE . 5.0 mptp? -105.45 159.31 16.03 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.684 1.194 . . . . 64.3 110.734 177.081 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.4 ' HB3' HG23 ' A' ' 92' ' ' VAL . 13.5 t70 -69.49 145.46 52.69 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 114.187 -1.369 . . . . 73.41 109.254 172.706 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -25.69 68.42 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 123.886 0.874 . . . . 75.2 113.093 -176.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 65.6 mtm -87.58 -9.01 55.55 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.672 0.789 . . . . 74.54 111.276 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.4 HG23 ' HB3' ' A' ' 89' ' ' ASP . 39.8 t -102.53 135.98 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 109.528 -0.545 . . . . 71.44 109.528 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -79.64 138.17 37.32 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.233 1.013 . . . . 61.01 111.387 -172.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.511 ' HH2' ' HB ' ' A' ' 86' ' ' ILE . 6.0 m95 -80.38 -52.8 7.25 Favored 'General case' 0 N--CA 1.483 1.217 0 N-CA-C 113.277 0.844 . . . . 73.22 113.277 -174.794 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.87 -18.16 54.52 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.782 0.833 . . . . 63.41 112.843 -174.664 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.1 t -74.67 -40.77 61.21 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.168 0.987 . . . . 64.52 110.267 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.676 HD13 ' HZ2' ' A' ' 88' ' ' LYS . 16.2 mt -94.12 -15.54 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 CA-C-N 115.162 -0.926 . . . . 73.41 112.552 -168.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -49.63 -47.89 77.64 Favored Pre-proline 0 N--CA 1.491 1.579 0 CA-C-O 118.193 -0.908 . . . . 71.33 113.114 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -56.36 -39.12 93.39 Favored 'Trans proline' 0 C--N 1.396 3.073 0 C-N-CA 122.012 1.808 . . . . 60.03 113.126 176.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.461 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 8.3 mm-40 -63.61 -50.95 67.36 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.344 0.658 . . . . 74.11 110.403 -178.674 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.44 ' O ' HD13 ' A' ' 105' ' ' LEU . 76.4 mt -61.17 -54.84 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.017 -0.992 . . . . 74.24 110.489 -177.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 89.1 mt -55.37 -38.28 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 123.511 0.724 . . . . 74.23 110.96 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -66.17 -43.69 86.19 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.493 0.717 . . . . 73.54 111.112 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 88.9 mt -64.35 -38.57 91.52 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.463 0.705 . . . . 74.23 111.194 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.575 HD12 HD11 ' A' ' 63' ' ' LEU . 10.0 mp -63.52 -34.45 77.81 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.645 0.778 . . . . 75.23 110.277 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.421 HG23 ' HB ' ' A' ' 17' ' ' ILE . 93.1 m -72.96 -31.32 64.48 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.302 0.641 . . . . 74.0 110.102 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -63.86 -54.42 35.22 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.9 0.48 . . . . 61.22 110.35 176.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -58.27 -45.05 88.58 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 123.824 0.703 . . . . 73.44 111.541 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.402 HD21 ' HA ' ' A' ' 40' ' ' LEU . 95.8 mt -75.93 -17.83 59.6 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.091 -0.959 . . . . 50.23 111.434 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.34 -28.8 59.75 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.143 0.577 . . . . 63.22 110.418 172.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -72.31 -27.09 62.23 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.148 -0.478 . . . . 65.12 109.921 168.71 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.67 30.38 64.12 Favored Glycine 0 C--N 1.353 1.516 0 CA-C-N 115.513 -0.767 . . . . 65.33 111.213 -172.623 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -92.91 139.96 29.98 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.441 1.096 . . . . 74.34 111.151 -171.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.424 ' HA ' ' O ' ' A' ' 40' ' ' LEU . 5.8 m-20 -76.65 119.11 20.01 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.474 -0.936 . . . . 74.52 108.474 169.331 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 2.7 p . . . . . 0 CA--C 1.553 1.074 0 C-N-CA 125.636 1.574 . . . . 53.53 112.385 -176.22 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.8 mt . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 109.808 -0.441 . . . . 73.11 109.808 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -72.31 122.24 20.81 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.421 -0.809 . . . . 73.33 109.564 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.8 mm -115.55 122.22 68.91 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 105.599 -2.0 . . . . 51.54 105.599 177.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -91.01 120.59 32.13 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.308 -0.997 . . . . 74.25 108.308 -172.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.7 m -93.25 113.29 25.46 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.522 -0.918 . . . . 63.52 108.522 -176.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.9 mt -105.83 138.14 42.53 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.601 0.76 . . . . 44.53 109.388 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.0 p -73.71 142.63 46.34 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.708 0.803 . . . . 71.42 110.695 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 p -113.09 168.0 8.4 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 124.681 1.192 . . . . 71.03 109.827 -174.71 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -67.73 -10.87 30.21 Favored 'Trans proline' 0 C--N 1.383 2.388 0 C-N-CA 122.693 2.262 . . . . 71.42 113.459 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -125.12 134.52 52.42 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.456 0.702 . . . . 71.44 109.761 -178.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -73.2 -24.85 60.57 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.279 0.632 . . . . 53.12 110.973 173.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -66.08 -20.75 66.26 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.115 0.966 . . . . 60.21 111.218 176.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.1 162.56 22.22 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.24 1.016 . . . . 74.41 110.107 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.4 tp -160.66 131.24 5.36 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 109.571 -0.529 . . . . 71.14 109.571 173.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -85.44 117.11 24.16 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.281 1.032 . . . . 72.53 110.85 -174.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -107.77 110.8 22.7 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.399 1.079 . . . . 73.44 108.216 173.29 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.6 tp -102.84 123.61 46.81 Favored 'General case' 0 C--O 1.243 0.744 0 N-CA-C 108.674 -0.861 . . . . 55.13 108.674 -169.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.1 p -80.87 106.21 12.7 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 107.828 -1.175 . . . . 71.44 107.828 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.2 p -109.89 -58.52 2.05 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.765 0.826 . . . . 74.43 110.181 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -69.72 110.29 4.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.135 0.974 . . . . 63.13 111.607 -172.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.08 -85.23 1.01 Allowed Glycine 0 C--N 1.342 0.911 0 O-C-N 124.107 0.879 . . . . 63.1 112.989 174.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.8 mp0 -95.62 164.14 12.9 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.9 0.88 . . . . 62.44 111.993 -170.741 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.3 ttt -125.58 147.28 49.34 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.077 1.751 . . . . 63.2 107.554 -177.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.7 mt -67.35 -51.97 45.84 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.085 0.772 . . . . 61.33 113.085 -169.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.62 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 43.9 tt0 . . . . . 0 N--CA 1.478 0.938 0 C-N-CA 123.239 0.616 . . . . 70.1 109.55 -172.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.5 p . . . . . 0 CA--C 1.541 0.605 0 N-CA-C 110.04 -0.356 . . . . 73.41 110.04 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -98.26 162.49 13.16 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.635 0.774 . . . . 75.14 110.067 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 p -82.82 99.5 9.74 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.615 0.766 . . . . 70.34 109.774 176.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.0 mt -76.87 107.73 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 123.142 0.577 . . . . 73.4 110.377 -173.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 76.8 t -87.55 105.34 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 108.046 -1.094 . . . . 74.24 108.046 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 75.2 mt -94.83 109.09 21.73 Favored 'Isoleucine or valine' 0 C--N 1.337 0.062 0 N-CA-C 107.999 -1.112 . . . . 75.13 107.999 -178.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -87.64 142.22 28.01 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.679 0.792 . . . . 72.42 109.77 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.505 ' HA ' HD11 ' A' ' 58' ' ' ILE . 36.9 p30 -67.43 -22.45 65.51 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.245 0.618 . . . . 74.35 111.574 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.2 t -87.85 -4.79 58.83 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.95 0.9 . . . . 71.42 112.043 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -108.11 103.7 12.97 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.102 0.561 . . . . 62.34 110.186 -175.24 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -45.44 -61.97 1.46 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 124.932 1.293 . . . . 55.3 113.605 176.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -69.65 -30.95 68.76 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.758 0.651 . . . . 53.31 112.758 -166.062 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.17 -36.17 83.18 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 123.397 0.436 . . . . 73.32 111.666 175.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.505 HD11 ' HA ' ' A' ' 52' ' ' ASN . 39.6 mt -84.22 -38.17 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 123.309 0.644 . . . . 62.13 110.381 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -56.19 -39.85 73.06 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 125.061 1.344 . . . . 64.4 112.15 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -85.98 -1.98 57.85 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.798 -0.637 . . . . 71.41 111.566 -176.685 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.0 p -127.78 101.38 6.33 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.208 0.603 . . . . 73.22 111.135 -172.828 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -57.65 -47.28 82.72 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.473 1.109 . . . . 74.32 112.287 -177.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.403 HD11 HD12 ' A' ' 105' ' ' LEU . 49.5 tp -63.93 -35.99 82.47 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 123.912 0.758 . . . . 74.31 111.409 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.39 -40.94 89.96 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.668 0.387 . . . . 72.11 111.189 178.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.419 ' HG2' HG22 ' A' ' 58' ' ' ILE . 23.9 mt-30 -58.79 -43.5 90.5 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 124.241 0.963 . . . . 72.55 110.242 176.184 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -58.66 -51.45 69.88 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.644 0.778 . . . . 75.14 112.519 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 83.3 mt -66.18 -44.54 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.434 0.694 . . . . 62.51 111.35 -173.563 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -71.13 -37.69 72.3 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 112.243 0.46 . . . . 72.0 112.243 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 42.9 tp -69.87 -45.92 66.65 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.865 0.466 . . . . 71.34 110.919 -177.466 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -81.08 -29.88 34.84 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.222 0.609 . . . . 74.53 111.691 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 63.9 m -133.28 88.11 36.5 Favored Pre-proline 0 CA--C 1.548 0.904 0 N-CA-C 109.057 -0.72 . . . . 73.42 109.057 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -77.02 -2.32 12.56 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 122.735 2.29 . . . . 72.1 112.758 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.04 3.4 71.13 Favored Glycine 0 C--N 1.356 1.659 0 CA-C-N 116.327 -0.397 . . . . 71.43 113.18 176.151 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.0 t -92.68 133.3 34.42 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.405 1.082 . . . . 74.41 109.974 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.458 ' H ' ' HA ' ' A' ' 88' ' ' LYS . 16.2 mm-40 -86.16 -49.95 7.36 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.381 1.072 . . . . 72.34 110.703 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.6 p -159.21 163.46 35.91 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.488 -0.778 . . . . 71.41 111.066 -175.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.4 mt -121.86 125.98 47.68 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 108.535 -0.913 . . . . 54.25 108.535 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.6 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.1 ttm -98.64 99.82 10.98 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 106.897 -1.519 . . . . 61.4 106.897 174.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.636 HD13 HD13 ' A' ' 84' ' ' LEU . 19.1 mm -85.41 110.67 19.78 Favored 'Isoleucine or valine' 0 C--O 1.242 0.662 0 N-CA-C 108.765 -0.828 . . . . 75.42 108.765 -172.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -101.25 173.68 24.38 Favored Glycine 0 C--O 1.247 0.931 0 N-CA-C 109.802 -1.319 . . . . 63.12 109.802 173.285 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.62 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 10.5 p-10 -74.93 -44.66 47.32 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 122.87 0.468 . . . . 64.33 110.022 175.461 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -86.81 -41.72 13.85 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.448 0.699 . . . . 70.23 111.468 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 36.4 p90 -131.2 171.62 13.08 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 121.247 0.546 . . . . 72.4 112.204 -164.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.636 HD13 HD13 ' A' ' 79' ' ' ILE . 14.1 tp -139.51 110.8 6.99 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.731 1.212 . . . . 63.53 107.915 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.6 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 66.7 m -95.42 108.18 20.37 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.088 -1.079 . . . . 70.55 108.088 -177.787 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.613 HG13 HD13 ' A' ' 101' ' ' ILE . 12.0 mm -87.01 102.9 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.501 0.72 . . . . 74.34 109.152 -173.456 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -84.2 128.08 34.34 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 107.33 -1.359 . . . . 72.33 107.33 175.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.458 ' HA ' ' H ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -148.93 168.1 23.98 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.603 0.761 . . . . 73.21 111.867 -171.28 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -71.42 122.79 21.01 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.197 1.399 . . . . 71.31 109.799 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -71.45 -12.5 61.43 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 113.147 0.795 . . . . 72.12 113.147 -170.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.7 mmm -78.06 -30.94 50.02 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.754 -0.461 . . . . 75.3 109.754 175.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.6 t -83.34 144.94 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 107.923 -1.14 . . . . 75.33 107.923 175.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -102.14 158.65 16.01 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.3 0.64 . . . . 72.4 111.636 -171.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -75.68 -24.73 56.31 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.977 0.911 . . . . 72.22 112.143 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -59.86 -27.32 66.58 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.423 0.689 . . . . 64.44 111.223 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.2 m -92.79 -35.55 13.35 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.954 0.902 . . . . 62.24 112.412 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.433 HG22 HD11 ' A' ' 101' ' ' ILE . 24.5 mt -93.28 -45.66 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 CA-C-N 117.861 0.301 . . . . 52.14 111.212 -170.226 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -53.5 -46.29 98.19 Favored Pre-proline 0 N--CA 1.492 1.674 0 N-CA-C 114.522 1.304 . . . . 72.4 114.522 -174.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -55.41 -39.59 90.2 Favored 'Trans proline' 0 C--N 1.392 2.866 0 C-N-CA 121.803 1.668 . . . . 62.12 112.168 175.37 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -68.22 -40.45 82.08 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.466 -0.788 . . . . 75.53 110.382 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.613 HD13 HG13 ' A' ' 86' ' ' ILE . 84.8 mt -62.48 -52.01 65.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.551 0.74 . . . . 72.12 110.364 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 79.4 mt -61.32 -37.54 77.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.369 0.668 . . . . 63.3 110.83 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.25 -47.69 72.92 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.431 0.692 . . . . 53.32 111.057 178.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 98.4 mt -68.44 -35.26 77.35 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.761 0.825 . . . . 62.53 111.99 -179.012 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.403 HD12 HD11 ' A' ' 63' ' ' LEU . 9.0 mp -69.34 -23.79 63.82 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.315 0.646 . . . . 71.3 110.492 175.084 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 53.8 m -78.9 -44.96 21.58 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.265 0.626 . . . . 72.23 109.993 173.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -57.46 -49.58 75.82 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.017 0.927 . . . . 64.31 110.483 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -50.57 -60.74 2.71 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.556 1.142 . . . . 74.52 111.366 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.4 mt -75.43 -19.11 59.68 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 115.682 -0.69 . . . . 74.54 112.058 -170.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.53 -46.72 14.07 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.599 0.76 . . . . 74.45 110.769 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -80.15 -15.02 57.99 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 115.92 -0.582 . . . . 64.34 111.208 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 84.45 19.27 60.63 Favored Glycine 0 C--N 1.35 1.316 0 CA-C-N 116.405 -0.361 . . . . 74.0 112.796 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.15 167.75 17.12 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.442 1.097 . . . . 71.35 111.148 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.36 139.4 34.18 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.323 1.049 . . . . 64.45 110.172 -174.548 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 108.868 -0.79 . . . . 70.11 108.868 165.857 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.0 mt . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.136 -0.69 . . . . 75.32 109.136 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -64.15 118.54 8.72 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.848 1.259 . . . . 74.13 110.389 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 42.1 mm -122.37 113.42 38.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 N-CA-C 106.193 -1.78 . . . . 75.22 106.193 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -105.57 119.96 40.44 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 106.891 -1.522 . . . . 65.43 106.891 -175.449 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.503 HG21 ' HD2' ' A' ' 98' ' ' LYS . 12.3 t -109.58 111.81 23.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-O 121.834 0.826 . . . . 72.12 108.934 -171.458 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.0 mt -91.56 147.6 22.89 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.152 -0.931 . . . . 73.3 111.342 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.9 p -81.66 145.86 30.34 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.669 -1.15 . . . . 74.25 110.011 176.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 50.1 p -115.81 176.65 1.44 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 107.939 -1.134 . . . . 73.32 107.939 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -49.8 -30.35 22.89 Favored 'Trans proline' 0 C--N 1.384 2.41 0 C-N-CA 122.079 1.852 . . . . 45.32 113.4 165.548 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -86.19 146.26 26.63 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 109.083 -0.71 . . . . 73.03 109.083 174.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -88.76 -36.22 16.24 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.946 0.898 . . . . 71.23 110.838 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -91.49 -17.39 25.78 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.461 1.104 . . . . 53.42 111.982 -171.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -99.77 109.34 21.77 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.219 -1.03 . . . . 75.45 108.219 169.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.2 tp -114.96 126.77 55.16 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.696 -0.853 . . . . 52.4 108.696 -175.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -92.47 110.08 21.48 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.088 0.955 . . . . 75.34 110.294 -170.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -92.56 127.19 37.96 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.599 0.76 . . . . 74.23 109.642 -177.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.3 tp -117.65 137.94 52.31 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.565 0.746 . . . . 73.2 109.835 -179.156 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.0 t -89.99 121.27 31.93 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.314 -0.995 . . . . 65.12 108.314 170.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 34.3 p -99.6 0.62 42.53 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.455 0.539 . . . . 72.24 112.455 -176.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -103.53 33.11 3.49 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.022 0.529 . . . . 73.35 111.721 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.68 -44.99 3.29 Favored Glycine 0 C--N 1.347 1.151 0 CA-C-O 119.755 -0.47 . . . . 73.44 113.97 171.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.518 ' HB3' HD22 ' A' ' 109' ' ' LEU . 9.3 mm-40 -59.29 92.06 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.68 0.792 . . . . 64.34 112.764 -177.199 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 51.4 ttm -78.94 138.54 38.13 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 114.822 -1.081 . . . . 53.43 109.104 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.3 mt -63.86 -56.14 17.59 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.772 0.829 . . . . 62.45 111.279 -172.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 107.895 -1.15 . . . . 65.25 107.895 173.096 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 CA--C 1.547 0.847 0 CA-C-O 121.255 0.55 . . . . 60.01 111.27 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -112.79 158.13 20.49 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.585 1.154 . . . . 74.2 108.383 177.186 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.5 m -76.58 93.29 3.56 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.314 0.645 . . . . 74.45 110.038 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.442 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 56.1 mt -74.87 104.54 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.596 0.758 . . . . 72.23 110.246 -177.236 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.4 t -81.29 108.69 14.79 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 123.443 0.697 . . . . 73.2 109.165 -178.106 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 53.3 mt -106.06 108.36 24.88 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 N-CA-C 107.348 -1.353 . . . . 73.11 107.348 175.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -94.71 166.01 12.21 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 108.725 -0.842 . . . . 73.52 108.725 175.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.46 ' HA ' HD11 ' A' ' 58' ' ' ILE . 30.7 p30 -70.9 -8.9 56.19 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 120.65 0.262 . . . . 62.35 111.548 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.3 p -85.56 -25.31 26.82 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.494 0.718 . . . . 70.11 110.928 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -86.39 70.68 10.51 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.254 0.622 . . . . 74.41 109.495 177.197 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -56.65 -37.45 70.79 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.529 -0.759 . . . . 71.12 111.025 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -53.08 -44.83 67.86 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.614 1.166 . . . . 75.42 111.734 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.6 mt -73.39 -30.39 63.24 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 116.084 -0.507 . . . . 63.33 111.659 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.46 HD11 ' HA ' ' A' ' 52' ' ' ASN . 77.6 mt -70.17 -43.47 78.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 123.648 0.779 . . . . 65.2 110.66 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -54.08 -39.52 66.4 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.647 0.779 . . . . 61.12 112.703 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -99.08 28.84 4.17 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 120.88 0.371 . . . . 74.44 111.907 -177.542 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.6 t -151.25 100.31 2.74 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 108.652 -0.869 . . . . 75.34 108.652 173.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -56.95 -38.34 72.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.769 0.828 . . . . 73.45 110.288 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.539 HD11 HD12 ' A' ' 105' ' ' LEU . 31.8 tp -59.91 -45.08 93.72 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 124.124 0.89 . . . . 65.45 110.492 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.61 -43.41 96.94 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.1 0.56 . . . . 64.15 111.645 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -56.29 -50.65 70.82 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 124.14 0.9 . . . . 70.22 110.758 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 93.4 mm-40 -66.4 -39.03 88.77 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 124.299 1.0 . . . . 73.11 112.365 -177.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.439 HG21 HD21 ' A' ' 77' ' ' LEU . 77.8 mt -64.94 -50.61 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 122.561 0.344 . . . . 53.23 110.883 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -67.51 -31.43 71.54 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.696 0.398 . . . . 72.22 111.736 179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.8 tp -69.98 -53.59 17.05 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.04 0.536 . . . . 74.35 110.734 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -71.95 -29.32 64.14 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.672 -0.694 . . . . 64.23 111.205 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.645 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 37.9 m -132.29 93.23 26.34 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 123.119 0.568 . . . . 53.44 110.009 -176.786 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.29 -10.43 22.41 Favored 'Trans proline' 0 C--N 1.37 1.689 0 C-N-CA 122.981 2.454 . . . . 62.42 113.357 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -82.18 -3.05 90.69 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-O 119.988 -0.34 . . . . 64.21 113.407 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 91.7 t -77.18 121.73 30.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 C-N-CA 123.542 0.737 . . . . 75.01 109.66 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -74.47 -48.78 25.3 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.854 0.862 . . . . 74.43 109.706 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.8 t -162.5 154.81 19.02 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.401 -1.272 . . . . 45.43 110.717 -170.294 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.439 HD21 HG21 ' A' ' 67' ' ' ILE . 36.2 mt -108.35 158.11 17.79 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.096 1.359 . . . . 73.1 108.745 169.614 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.439 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.0 ttm -137.49 113.92 10.21 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.246 -1.02 . . . . 75.35 108.246 170.439 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.602 HD13 HD13 ' A' ' 84' ' ' LEU . 22.0 mm -88.91 118.55 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 N-CA-C 107.958 -1.127 . . . . 63.24 107.958 -175.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -108.51 -164.21 20.86 Favored Glycine 0 C--O 1.242 0.652 0 N-CA-C 111.852 -0.499 . . . . 75.45 111.852 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -73.13 -74.68 0.16 Allowed 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.302 -0.999 . . . . 70.45 108.302 174.125 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -87.48 -19.79 27.46 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.088 1.355 . . . . 74.14 111.122 -176.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -119.77 160.49 22.49 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.808 0.67 . . . . 74.24 112.808 -164.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 79' ' ' ILE . 28.3 tp -135.99 109.77 8.11 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.415 -1.266 . . . . 73.01 107.803 170.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.439 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 36.9 m -96.21 108.44 20.91 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.317 -0.623 . . . . 74.24 109.317 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 26.3 mm -90.67 127.56 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 108.984 -0.747 . . . . 55.42 108.984 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -107.8 128.52 54.67 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 108.011 -1.107 . . . . 55.55 108.011 178.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.6 170.25 16.25 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.75 0.82 . . . . 74.53 110.106 178.35 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -85.26 134.78 34.12 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 109.515 -0.55 . . . . 74.32 109.515 173.328 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.2 ptp180 -55.1 -31.31 61.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.31 1.044 . . . . 70.13 113.656 -174.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 84.0 mtp -67.49 -26.79 66.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 122.721 0.408 . . . . 74.11 111.146 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 18.6 t -89.41 136.5 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 107.902 -1.147 . . . . 73.0 107.902 173.651 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -91.85 150.51 21.02 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.899 0.48 . . . . 73.22 111.537 -173.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -68.09 -15.71 63.71 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.243 0.617 . . . . 71.21 110.49 169.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -57.7 -31.01 65.97 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.115 0.966 . . . . 73.41 111.555 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.9 t -103.19 -17.12 15.49 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.406 0.682 . . . . 71.22 111.405 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.645 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 68.3 mt -100.96 -58.64 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 122.961 0.504 . . . . 70.54 111.13 -171.266 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.503 ' HD2' HG21 ' A' ' 21' ' ' THR . 27.7 ttpp -59.92 -46.24 98.2 Favored Pre-proline 0 CA--C 1.567 1.602 0 N-CA-C 114.606 1.336 . . . . 70.12 114.606 -170.462 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -60.29 -35.16 92.61 Favored 'Trans proline' 0 C--N 1.396 3.057 0 CA-C-N 122.002 1.751 . . . . 72.35 112.02 178.474 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -66.74 -46.45 75.39 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.463 -0.79 . . . . 63.42 109.837 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.41 ' O ' HD13 ' A' ' 105' ' ' LEU . 50.1 mt -67.42 -45.86 84.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 O-C-N 123.979 0.799 . . . . 74.33 111.528 -177.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.69 -40.67 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 122.746 0.418 . . . . 73.44 110.694 178.262 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -64.27 -41.28 96.99 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.894 0.746 . . . . 64.42 110.91 177.052 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.5 -36.84 85.49 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.639 0.776 . . . . 62.35 111.398 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.539 HD12 HD11 ' A' ' 63' ' ' LEU . 8.2 mp -69.25 -33.4 73.2 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.477 0.711 . . . . 61.13 109.939 175.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.9 m -71.27 -34.6 70.85 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.176 0.59 . . . . 61.13 109.642 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -69.09 -56.64 7.09 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 122.975 0.51 . . . . 64.13 110.266 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.92 -42.94 85.85 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.681 1.192 . . . . 71.31 111.24 -173.098 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.518 HD22 ' HB3' ' A' ' 38' ' ' GLU . 95.8 mt -73.42 -34.82 65.67 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.123 0.569 . . . . 72.54 111.418 178.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.16 -29.27 68.12 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 122.965 0.506 . . . . 71.15 111.35 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -74.3 -34.55 63.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.802 -0.635 . . . . 71.35 110.063 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.15 35.55 53.03 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-N 115.535 -0.757 . . . . 72.11 112.358 -179.411 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -98.74 -179.93 4.46 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.642 0.777 . . . . 72.41 110.705 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -87.81 143.38 27.17 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.936 0.494 . . . . 74.45 110.04 174.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 CA--C 1.546 0.794 0 N-CA-C 109.341 -0.614 . . . . 75.05 109.341 171.082 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.7 mp . . . . . 0 CA--C 1.545 0.784 0 CA-C-O 121.432 0.634 . . . . 64.01 112.042 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.1 m80 -87.71 137.28 32.47 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 125.108 1.363 . . . . 63.12 109.393 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.404 ' HB ' HG23 ' A' ' 102' ' ' ILE . 51.5 mm -121.76 117.16 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 107.019 -1.474 . . . . 73.33 107.019 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.527 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.8 ttmm -90.62 138.0 31.91 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.465 -0.939 . . . . 73.53 108.465 -178.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 85.2 m -105.55 124.61 49.84 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 108.395 -0.965 . . . . 65.45 108.395 174.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.6 mt -117.54 136.26 53.37 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 108.747 -0.834 . . . . 73.15 108.747 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.3 p -68.06 144.68 54.99 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.854 0.862 . . . . 73.43 110.432 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.3 p -126.2 147.84 61.18 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.364 1.066 . . . . 71.43 109.312 -173.368 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.94 -28.91 66.81 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 122.537 2.158 . . . . 64.44 112.033 171.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -87.16 117.23 25.77 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.196 0.999 . . . . 45.42 108.718 176.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -73.82 -29.78 62.34 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.535 0.734 . . . . 74.45 112.342 -175.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -74.35 -26.36 60.09 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 122.644 0.378 . . . . 73.11 110.588 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -90.11 158.91 17.06 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.411 0.684 . . . . 65.14 110.856 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.3 tp -158.67 123.13 4.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.335 -0.987 . . . . 64.14 108.335 168.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -84.22 129.95 34.86 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.041 0.936 . . . . 65.22 110.636 -174.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -118.57 118.56 32.01 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.257 1.023 . . . . 73.04 108.512 174.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.527 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 60.6 tp -100.88 124.65 46.87 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 109.218 -0.66 . . . . 74.33 109.218 -172.792 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.0 m -80.92 105.37 12.09 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.453 -0.943 . . . . 74.35 108.453 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 57.2 p -91.52 -6.16 52.97 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 112.943 0.719 . . . . 63.04 112.943 -168.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -97.15 178.02 5.39 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.075 0.95 . . . . 72.1 109.442 178.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.42 -11.72 29.16 Favored Glycine 0 N--CA 1.48 1.613 0 N-CA-C 114.208 0.443 . . . . 61.41 114.208 -175.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.471 ' HB3' HD22 ' A' ' 109' ' ' LEU . 11.4 mp0 -81.23 89.02 6.01 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.52 1.128 . . . . 72.44 109.832 175.322 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.7 ttt -93.53 136.45 33.8 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 108.063 -1.088 . . . . 61.34 108.063 172.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.405 ' HB3' HG11 ' A' ' 115' ' ' VAL . 77.5 mt -68.53 -59.51 3.09 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.933 0.493 . . . . 71.54 112.106 -167.494 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.534 ' HB2' ' HA ' ' A' ' 81' ' ' ASP . 26.3 mt-30 . . . . . 0 N--CA 1.482 1.162 0 C-N-CA 123.721 0.808 . . . . 70.31 109.46 172.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.3 m . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.855 0.36 . . . . 73.13 110.584 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -94.64 132.47 39.32 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 108.385 -0.969 . . . . 73.2 108.385 173.003 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.3 p -70.01 115.71 9.53 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.661 0.785 . . . . 64.03 110.217 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.1 mt -74.33 102.02 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 109.017 -0.734 . . . . 74.43 109.017 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 89.7 t -91.65 106.97 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.604 -0.888 . . . . 60.34 108.604 -179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.508 HG12 ' HB3' ' A' ' 57' ' ' LEU . 66.4 mt -104.39 110.0 29.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 N-CA-C 108.065 -1.087 . . . . 60.43 108.065 -178.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' HB3' ' A' ' 76' ' ' SER . 54.1 mtmt -91.34 161.24 15.1 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.247 -0.649 . . . . 71.11 109.247 177.718 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.451 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 27.6 p30 -63.64 -18.27 63.76 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.0 0.92 . . . . 72.02 112.307 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -82.85 -27.17 31.0 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.67 0.788 . . . . 62.21 111.735 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.445 ' O ' HG13 ' A' ' 58' ' ' ILE . 31.1 m-20 -83.67 77.17 9.91 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.519 0.728 . . . . 72.42 111.601 -173.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -49.68 -46.31 49.78 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.196 0.998 . . . . 52.42 112.084 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -54.19 -48.02 71.43 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.495 1.118 . . . . 75.23 111.467 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.508 ' HB3' HG12 ' A' ' 50' ' ' ILE . 83.6 mt -73.6 -28.96 62.1 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 115.525 -0.761 . . . . 73.13 111.347 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.487 HG22 ' HG2' ' A' ' 65' ' ' GLN . 87.9 mt -70.81 -39.32 75.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 123.508 0.723 . . . . 63.43 110.393 178.23 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -66.16 -23.55 66.49 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.556 0.342 . . . . 74.44 111.516 174.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -72.05 -10.68 60.11 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 112.869 0.692 . . . . 75.33 112.869 172.383 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.4 m -140.83 105.31 4.87 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 122.841 0.456 . . . . 74.44 110.513 -177.366 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -59.31 -32.8 70.39 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.62 0.768 . . . . 74.45 110.401 174.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.2 tp -60.3 -44.73 95.15 Favored 'General case' 0 C--N 1.356 0.849 0 C-N-CA 123.988 0.915 . . . . 35.45 110.876 175.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.94 99.47 Favored 'General case' 0 C--N 1.357 0.906 0 O-C-N 123.845 0.715 . . . . 61.12 110.511 -178.419 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.487 ' HG2' HG22 ' A' ' 58' ' ' ILE . 82.8 mt-30 -57.4 -43.89 84.06 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 124.509 1.13 . . . . 72.0 110.862 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -69.23 -39.29 78.61 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 123.569 0.543 . . . . 53.13 112.026 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.461 HG21 HD21 ' A' ' 77' ' ' LEU . 59.8 mt -64.99 -49.07 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.435 0.694 . . . . 61.13 110.658 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -69.88 -27.23 64.64 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.121 0.568 . . . . 73.43 111.602 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 66.6 tp -69.66 -48.52 59.54 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.141 0.576 . . . . 74.43 110.845 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -74.48 -33.37 62.85 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.432 -0.804 . . . . 64.25 111.442 -177.352 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 52.4 t -142.95 94.18 6.48 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 108.759 -0.83 . . . . 74.34 108.759 -178.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -71.44 -2.01 10.61 Favored 'Trans proline' 0 C--N 1.373 1.851 0 C-N-CA 123.245 2.63 . . . . 75.41 112.733 174.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.69 -20.24 74.34 Favored Glycine 0 C--N 1.355 1.608 0 N-CA-C 111.687 -0.565 . . . . 74.25 111.687 177.019 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 85.9 t -65.39 118.3 7.68 Favored 'Isoleucine or valine' 0 C--N 1.354 0.789 0 C-N-CA 123.649 0.78 . . . . 62.23 109.713 175.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.451 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 40.5 mt-10 -82.15 -41.98 19.69 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.205 1.002 . . . . 44.44 110.871 -175.561 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.509 ' HB3' ' HG2' ' A' ' 51' ' ' LYS . 74.6 p -159.14 165.53 33.57 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.632 0.73 . . . . 61.51 111.999 -175.734 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.461 HD21 HG21 ' A' ' 67' ' ' ILE . 46.5 mt -129.1 127.78 42.16 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 106.905 -1.517 . . . . 72.4 106.905 176.08 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.495 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.3 ttm -103.32 109.1 20.59 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 108.11 -1.07 . . . . 64.02 108.11 173.177 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.61 HD13 HD13 ' A' ' 84' ' ' LEU . 13.6 mm -84.29 103.8 11.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 107.046 -1.465 . . . . 71.4 107.046 177.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.97 -168.74 43.14 Favored Glycine 0 C--O 1.245 0.816 0 N-CA-C 111.617 -0.593 . . . . 71.45 111.617 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.534 ' HA ' ' HB2' ' A' ' 41' ' ' GLN . 1.9 m-20 -76.26 -61.63 1.88 Allowed 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.678 -0.86 . . . . 74.42 108.678 -178.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -97.04 -14.73 21.42 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.112 0.965 . . . . 72.14 111.361 -178.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -134.65 156.25 49.07 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.381 0.512 . . . . 61.1 112.381 -159.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.61 HD13 HD13 ' A' ' 79' ' ' ILE . 22.6 tp -125.14 114.97 19.73 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.889 1.275 . . . . 74.22 107.921 174.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.495 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 30.8 m -102.44 108.86 20.33 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.452 -0.944 . . . . 70.04 108.452 -178.063 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.0 mm -87.4 136.95 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 107.908 -1.145 . . . . 70.41 107.908 -178.07 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -123.07 126.43 47.07 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 108.657 -0.868 . . . . 71.14 108.657 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -129.01 167.43 17.48 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.333 0.653 . . . . 74.34 109.573 177.111 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -59.71 141.94 54.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.075 0.95 . . . . 63.21 110.01 174.099 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -54.38 -38.8 66.56 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.513 0.725 . . . . 73.25 112.275 -172.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 45.3 ttp -75.81 -28.13 58.21 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.618 0.767 . . . . 71.32 111.216 -175.105 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.405 HG12 HD11 ' A' ' 97' ' ' ILE . 44.3 t -72.04 134.47 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 N-CA-C 108.458 -0.942 . . . . 63.44 108.458 172.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -104.13 160.78 14.57 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.149 0.579 . . . . 75.41 110.929 -176.072 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -77.94 -13.78 59.76 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.471 1.109 . . . . 72.43 113.547 -175.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -64.56 -28.36 69.59 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.28 0.632 . . . . 75.21 111.919 -171.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.2 m -95.24 -23.93 17.02 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.779 0.832 . . . . 72.52 111.546 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.405 HD11 HG12 ' A' ' 92' ' ' VAL . 50.7 mt -89.98 -48.93 14.13 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 123.813 0.845 . . . . 73.55 111.294 -168.61 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -51.62 -55.51 29.05 Favored Pre-proline 0 N--CA 1.487 1.395 0 CA-C-O 117.428 -1.272 . . . . 74.21 113.282 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -59.85 -38.19 81.33 Favored 'Trans proline' 0 C--N 1.396 3.049 0 CA-C-N 121.577 1.599 . . . . 63.1 112.314 -175.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.45 -48.03 57.86 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.049 0.54 . . . . 61.24 110.523 -175.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 13.1 mt -69.95 -45.23 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.49 0.716 . . . . 63.21 111.186 -178.166 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.404 HG23 ' HB ' ' A' ' 19' ' ' ILE . 58.1 mt -58.41 -37.4 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.067 0.547 . . . . 74.42 110.813 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -67.84 -45.77 73.7 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 123.687 0.617 . . . . 60.51 110.279 175.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.11 -33.74 72.53 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 123.867 0.867 . . . . 71.1 111.588 177.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.5 mp -74.05 -35.34 64.3 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.171 0.988 . . . . 65.05 110.654 178.17 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 85.5 m -72.07 -31.19 65.87 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 109.293 -0.632 . . . . 43.45 109.293 178.477 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.535 ' HA ' ' HE2' ' A' ' 107' ' ' LYS . 10.1 mmpt? -73.32 -52.96 12.02 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 123.932 0.893 . . . . 62.52 111.101 175.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -55.7 -53.14 60.3 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.783 0.833 . . . . 74.44 111.043 -178.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.471 HD22 ' HB3' ' A' ' 38' ' ' GLU . 78.7 mt -74.12 -10.8 59.98 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 114.844 -1.071 . . . . 73.42 111.417 -176.197 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.84 -27.4 62.87 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.706 0.402 . . . . 45.32 110.845 170.226 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -79.62 -52.04 8.49 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 107.51 -1.293 . . . . 75.44 107.51 168.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.82 -8.6 75.16 Favored Glycine 0 C--N 1.354 1.582 0 N-CA-C 115.838 1.095 . . . . 75.15 115.838 163.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.18 -70.46 0.27 Allowed 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 117.669 0.734 . . . . 52.02 111.108 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -134.1 126.09 29.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.122 0.569 . . . . 72.22 110.762 -171.943 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.405 HG11 ' HB3' ' A' ' 40' ' ' LEU . 3.9 p . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 107.997 -1.112 . . . . 62.34 107.997 158.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 106' ' ' THR . 74.7 mt . . . . . 0 CA--C 1.536 0.434 0 N-CA-C 108.941 -0.763 . . . . 73.45 108.941 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.454 ' H ' ' HB3' ' A' ' 36' ' ' ASP . 48.2 m80 -68.32 120.54 14.61 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 124.293 1.037 . . . . 71.24 110.848 -174.371 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.4 mm -118.19 123.71 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 N-CA-C 108.079 -1.082 . . . . 73.52 108.079 -173.127 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.526 ' HE3' HD21 ' A' ' 22' ' ' LEU . 56.6 tptt -96.78 112.27 24.09 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.684 1.194 . . . . 75.12 109.108 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.452 HG21 ' HE3' ' A' ' 98' ' ' LYS . 59.8 m -92.49 113.47 25.76 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 108.847 -0.797 . . . . 74.45 108.847 -178.627 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.526 HD21 ' HE3' ' A' ' 20' ' ' LYS . 95.4 mt -122.26 138.01 54.64 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.625 1.17 . . . . 64.23 109.591 -171.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.4 p -81.02 147.81 30.01 Favored 'General case' 0 C--O 1.24 0.56 0 O-C-N 124.073 0.858 . . . . 64.11 110.553 -178.431 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 36.6 p -125.38 158.0 65.76 Favored Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 124.136 0.974 . . . . 75.03 109.373 -174.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.13 -32.1 30.79 Favored 'Trans proline' 0 C--N 1.389 2.679 0 C-N-CA 123.289 2.66 . . . . 70.23 113.684 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -100.71 121.46 41.7 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 108.918 -0.771 . . . . 74.21 108.918 173.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -73.82 -15.37 61.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.112 0.565 . . . . 74.01 111.303 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.436 ' O ' ' HA ' ' A' ' 87' ' ' ASN . 13.2 m120 -71.9 -19.05 61.99 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 122.655 0.382 . . . . 52.45 110.609 170.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -102.41 159.7 15.19 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.56 1.144 . . . . 71.32 110.082 172.185 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.0 tp -160.28 120.91 2.96 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.14 -0.689 . . . . 71.44 109.14 176.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.9 ttmp? -82.44 120.75 25.86 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.044 0.538 . . . . 73.3 111.131 -176.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -105.24 111.86 24.76 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.381 -0.97 . . . . 71.14 108.381 169.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 59.5 tp -108.83 128.28 54.76 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.669 0.787 . . . . 62.31 109.665 -171.645 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 p -80.5 104.53 11.1 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.909 -0.774 . . . . 74.31 108.909 179.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.5 p -101.11 -6.74 23.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.743 0.817 . . . . 55.33 111.302 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASP . . . . . 0.454 ' HB3' ' H ' ' A' ' 18' ' ' HIS . 8.0 p-10 -69.44 -37.7 77.48 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.167 0.587 . . . . 75.43 110.316 177.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.31 -12.5 4.96 Favored Glycine 0 C--N 1.349 1.292 0 C-N-CA 123.371 0.51 . . . . 71.13 113.031 178.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.519 ' HG2' ' HB3' ' A' ' 109' ' ' LEU . 9.6 tp10 -78.04 149.03 34.06 Favored 'General case' 0 C--N 1.356 0.869 0 CA-C-N 117.567 0.683 . . . . 74.21 109.965 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 7.5 tpt -111.77 142.66 43.85 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.222 0.609 . . . . 72.44 109.992 -170.072 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.679 HD23 HD21 ' A' ' 109' ' ' LEU . 89.8 mt -86.0 -44.42 12.35 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.409 0.684 . . . . 74.45 111.378 -177.232 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.413 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.9 tp60 . . . . . 0 CA--C 1.561 1.376 0 N-CA-C 109.194 -0.669 . . . . 64.43 109.194 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.2 t . . . . . 0 N--CA 1.476 0.847 0 CA-C-O 121.125 0.488 . . . . 40.23 109.817 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.28 -176.31 3.26 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.301 1.041 . . . . 71.44 110.185 177.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.5 m -73.49 92.88 1.93 Allowed 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 109.355 -0.609 . . . . 71.43 109.355 173.294 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.561 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 46.9 mt -75.35 97.87 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 108.758 -0.83 . . . . 65.4 108.758 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.4 t -86.83 107.27 16.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.017 -1.105 . . . . 74.33 108.017 -176.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.6 mt -102.59 108.4 24.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 107.884 -1.154 . . . . 72.11 107.884 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -95.66 155.96 16.53 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.195 0.598 . . . . 65.42 109.66 -176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.442 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 34.5 p30 -60.47 -18.87 54.27 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.563 0.745 . . . . 72.42 112.364 -178.772 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.5 p -77.56 -41.27 39.53 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.774 0.83 . . . . 61.21 111.262 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -86.69 79.75 8.77 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.502 0.721 . . . . 73.54 110.552 -171.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -66.53 -22.82 66.17 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.28 -0.873 . . . . 74.32 112.21 -173.691 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -57.5 -46.88 83.24 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 121.052 0.453 . . . . 73.01 110.377 178.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.3 mt -73.2 -35.65 66.38 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.662 0.785 . . . . 63.14 110.523 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.402 HG22 ' HG2' ' A' ' 65' ' ' GLN . 72.1 mt -61.27 -42.54 93.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.337 1.055 . . . . 51.13 110.283 177.24 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASN . . . . . 0.433 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 83.1 m-20 -69.45 -29.19 66.83 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.159 0.584 . . . . 72.54 111.875 177.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -73.9 -33.14 63.88 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.142 0.577 . . . . 65.12 111.525 175.646 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.0 p -110.97 92.24 3.97 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 108.798 -0.816 . . . . 71.45 108.798 176.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -57.46 -23.4 49.61 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.718 0.807 . . . . 71.35 111.352 -175.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.405 HD11 HD12 ' A' ' 105' ' ' LEU . 62.4 tp -58.12 -46.73 85.09 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.062 1.345 . . . . 72.2 110.872 171.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.72 -39.27 93.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.939 0.896 . . . . 71.14 110.707 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.433 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 95.6 mt-30 -55.06 -47.84 74.31 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 123.651 0.594 . . . . 72.33 109.827 175.179 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -65.61 -45.31 83.64 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 115.135 -0.939 . . . . 74.1 112.845 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 69.2 mt -65.09 -49.1 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 123.112 0.565 . . . . 64.51 110.663 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -68.24 -30.12 69.1 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 116.107 -0.497 . . . . 75.41 111.372 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 41.0 tp -73.32 -46.99 46.17 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.107 0.563 . . . . 64.34 111.679 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -83.27 -17.42 42.65 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.316 0.647 . . . . 53.14 111.594 -173.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 51.6 t -141.96 105.58 5.73 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 123.352 0.661 . . . . 63.31 109.604 172.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.45 -8.53 22.77 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.949 2.433 . . . . 73.41 112.803 176.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.572 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -76.61 -21.9 73.78 Favored Glycine 0 C--N 1.345 1.037 0 CA-C-N 116.57 -0.286 . . . . 71.01 113.29 -178.023 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.53 122.68 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 122.989 0.516 . . . . 63.22 109.673 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.442 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 11.1 pt-20 -93.04 -33.77 13.97 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.755 0.822 . . . . 72.35 111.23 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.9 p -161.9 160.29 27.76 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.459 0.647 . . . . 63.44 112.023 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.411 HD22 HD12 ' A' ' 86' ' ' ILE . 40.7 mt -121.08 139.23 53.6 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.155 -1.424 . . . . 74.12 107.155 174.671 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.557 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 48.6 ttm -113.06 109.22 18.47 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 107.215 -1.402 . . . . 72.4 107.215 173.902 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.615 HG21 HG11 ' A' ' 115' ' ' VAL . 39.8 mm -92.49 127.18 44.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 109.342 -0.614 . . . . 72.21 109.342 -176.138 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -114.22 175.61 16.38 Favored Glycine 0 C--O 1.241 0.566 0 N-CA-C 109.677 -1.369 . . . . 41.24 109.677 166.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.413 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 23.5 m-20 -72.71 -44.61 61.5 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.582 0.706 . . . . 65.23 110.468 177.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -104.38 -39.51 6.42 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 125.014 1.326 . . . . 65.2 110.933 -174.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 18.1 p90 -111.21 155.58 22.73 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.292 0.637 . . . . 53.31 111.201 -175.467 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.46 HD21 HD11 ' A' ' 86' ' ' ILE . 54.3 tp -120.79 150.45 40.99 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 107.425 -1.324 . . . . 74.43 107.425 171.209 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 50.7 m -141.37 109.46 5.81 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.218 0.607 . . . . 43.45 109.76 175.798 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.499 HG13 HD13 ' A' ' 101' ' ' ILE . 29.5 mm -88.76 139.53 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 109.242 -0.651 . . . . 61.41 109.242 -178.685 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ASN . . . . . 0.436 ' HA ' ' O ' ' A' ' 28' ' ' ASN . 33.5 m-80 -118.35 133.82 55.56 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.454 0.702 . . . . 74.32 109.571 175.554 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.486 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -128.11 168.74 14.95 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.585 0.754 . . . . 71.32 109.978 -178.832 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 14.1 t70 -72.95 149.5 43.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.274 0.63 . . . . 71.55 110.179 173.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -50.14 -41.04 48.09 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.653 1.181 . . . . 65.44 114.184 -172.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 20.0 ptp -83.41 -18.03 40.14 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 122.752 0.421 . . . . 75.34 111.75 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.572 HG11 ' HA3' ' A' ' 73' ' ' GLY . 27.4 t -81.46 127.65 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.068 0.547 . . . . 72.44 109.545 -171.592 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -86.8 130.68 34.37 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.785 0.834 . . . . 74.21 110.601 -169.75 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.486 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 45.4 m95 -59.16 -31.41 68.96 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.507 0.723 . . . . 71.31 112.141 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -61.35 -26.19 67.66 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 122.767 0.427 . . . . 73.35 111.445 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.7 t -86.99 -18.73 29.97 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.698 0.799 . . . . 44.32 111.367 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.5 HD11 HG12 ' A' ' 92' ' ' VAL . 10.9 mt -104.09 -44.16 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.348 0 C-N-CA 123.043 0.537 . . . . 73.41 111.586 -170.51 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.452 ' HE3' HG21 ' A' ' 21' ' ' THR . 54.5 mtpt -52.91 -52.18 67.46 Favored Pre-proline 0 N--CA 1.491 1.595 0 C-N-CA 124.963 1.305 . . . . 74.24 113.706 -172.636 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -56.5 -40.07 87.0 Favored 'Trans proline' 0 C--N 1.393 2.919 0 C-N-CA 121.909 1.74 . . . . 74.24 112.049 -178.31 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.4 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 10.8 mm-40 -61.84 -53.76 51.44 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.79 -1.096 . . . . 75.31 110.03 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.499 HD13 HG13 ' A' ' 86' ' ' ILE . 48.2 mt -61.93 -51.06 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.077 0.951 . . . . 75.11 111.833 -176.566 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 83.2 mt -58.56 -40.17 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 123.308 0.643 . . . . 73.3 110.824 -177.904 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -66.99 -42.51 84.9 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.944 0.498 . . . . 63.24 110.74 178.352 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 90.7 mt -65.79 -35.57 81.08 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.163 0.985 . . . . 63.51 111.757 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.405 HD12 HD11 ' A' ' 63' ' ' LEU . 6.5 mp -62.36 -35.94 80.69 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.687 0.795 . . . . 63.31 109.95 174.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.541 ' HA ' HD12 ' A' ' 17' ' ' ILE . 26.3 m -74.26 -29.83 61.85 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.073 0.549 . . . . 63.24 110.054 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -65.53 -52.41 52.81 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.456 0.702 . . . . 65.12 110.31 174.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -66.88 -52.62 41.24 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.306 -0.861 . . . . 73.42 111.744 -174.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.679 HD21 HD23 ' A' ' 40' ' ' LEU . 95.4 mt -67.56 -18.03 64.86 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.551 -0.75 . . . . 61.13 111.528 -174.109 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.33 -19.4 65.45 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.717 0.807 . . . . 71.42 112.032 174.017 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -74.73 -29.23 61.1 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.992 0.517 . . . . 62.32 110.434 173.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.97 28.04 63.32 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.947 -0.57 . . . . 74.33 112.85 -177.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -115.81 -178.65 3.44 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.216 1.006 . . . . 62.12 110.064 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -70.14 169.47 13.49 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.189 0.596 . . . . 62.34 110.336 172.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.615 HG11 HG21 ' A' ' 79' ' ' ILE . 7.1 p . . . . . 0 N--CA 1.477 0.905 0 C-N-CA 123.896 0.878 . . . . 63.33 109.707 175.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.7 mt . . . . . 0 N--CA 1.475 0.824 0 CA-C-O 120.949 0.404 . . . . 62.01 110.747 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -77.31 112.92 14.53 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.254 1.021 . . . . 72.54 110.627 -175.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.448 ' HB ' HG23 ' A' ' 102' ' ' ILE . 50.1 mm -121.63 119.24 58.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 106.69 -1.596 . . . . 72.34 106.69 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -112.25 130.88 55.78 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.843 -1.169 . . . . 73.22 107.843 178.026 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.1 m -111.01 112.58 24.5 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.469 -0.567 . . . . 71.42 109.469 -175.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -97.62 139.67 33.17 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 123.396 0.678 . . . . 70.11 109.95 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 64.5 p -84.65 150.79 24.9 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.765 0.826 . . . . 74.45 110.223 -176.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 54.4 p -126.66 145.85 54.8 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.589 0.756 . . . . 63.14 109.587 -174.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -52.74 -41.08 71.99 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 123.203 2.602 . . . . 50.33 113.246 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -73.53 111.9 9.1 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.2 0.6 . . . . 60.44 109.858 172.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -71.99 -16.99 62.08 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.239 1.016 . . . . 65.0 112.368 -172.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -89.73 6.75 40.13 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.737 0.815 . . . . 61.12 111.5 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -135.47 159.34 41.9 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.391 1.077 . . . . 61.54 109.353 174.414 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.9 tp -156.86 127.55 6.66 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.314 -0.625 . . . . 74.52 109.314 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.54 114.7 26.97 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.367 0.667 . . . . 72.23 111.258 -173.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -103.19 125.35 49.83 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.748 1.219 . . . . 74.51 108.2 170.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.5 tp -130.71 136.69 49.02 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.501 0.72 . . . . 75.41 109.34 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.4 m -91.05 112.41 24.3 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.77 -0.826 . . . . 72.51 108.77 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.2 p -75.9 -5.74 47.56 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.249 0.62 . . . . 64.44 112.423 -174.497 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -71.0 -31.26 67.74 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.174 0.59 . . . . 65.43 110.141 169.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.96 36.28 3.23 Favored Glycine 0 C--N 1.344 1.01 0 CA-C-N 115.475 -0.784 . . . . 72.54 111.986 -174.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.404 ' HB3' HD22 ' A' ' 109' ' ' LEU . 22.7 mm-40 -83.71 81.87 8.57 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.545 0.688 . . . . 74.33 109.449 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 52.2 ttm -74.67 133.14 42.13 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 114.97 -1.013 . . . . 64.31 109.871 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 84' ' ' LEU . 75.4 mt -78.12 -57.67 3.66 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.238 0.615 . . . . 72.52 110.494 -174.534 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.523 ' HB2' ' HA ' ' A' ' 81' ' ' ASP . 10.1 mm100 . . . . . 0 CA--C 1.554 1.112 0 C-N-CA 124.387 1.075 . . . . 73.35 109.143 -177.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 73.7 m . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 120.978 0.418 . . . . 73.53 111.779 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.2 mmpt? -87.82 154.07 20.84 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.103 0.961 . . . . 73.54 110.329 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.4 m -77.65 91.9 4.06 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.571 0.748 . . . . 52.51 109.63 177.558 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.438 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 64.5 mt -73.47 109.15 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.311 1.044 . . . . 65.25 109.678 -175.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.2 t -87.04 110.06 19.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 109.225 -0.657 . . . . 71.15 109.225 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.416 HG23 ' HB2' ' A' ' 57' ' ' LEU . 76.0 mt -106.61 107.83 23.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 107.556 -1.275 . . . . 65.41 107.556 174.361 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -92.37 165.26 13.16 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 109.68 -0.489 . . . . 74.3 109.68 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -64.79 -24.46 67.56 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.507 0.723 . . . . 75.41 111.759 178.184 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.0 t -79.48 -22.88 43.47 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.403 0.681 . . . . 74.24 110.672 176.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -90.16 63.18 5.73 Favored 'General case' 0 C--N 1.354 0.771 0 C-N-CA 123.604 0.762 . . . . 63.22 109.894 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.478 ' HA ' HD12 ' A' ' 58' ' ' ILE . 38.1 tt0 -65.45 -23.82 67.02 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.897 -0.592 . . . . 75.35 110.466 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -61.67 -40.65 95.7 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.092 0.957 . . . . 62.31 111.278 175.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.416 ' HB2' HG23 ' A' ' 50' ' ' ILE . 96.0 mt -71.86 -41.38 68.16 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.273 0.629 . . . . 74.1 110.007 176.852 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.478 HD12 ' HA ' ' A' ' 55' ' ' GLU . 79.9 mt -59.2 -37.76 70.48 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 124.356 1.062 . . . . 73.12 111.103 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -58.47 -34.43 70.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.48 0.712 . . . . 74.25 111.699 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 53.0 m80 -94.95 13.71 24.07 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.031 0.932 . . . . 75.44 111.525 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.4 m -138.4 96.51 3.18 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.726 0.81 . . . . 53.01 109.793 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -55.73 -44.89 77.94 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.549 1.139 . . . . 73.03 112.388 -177.731 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.583 ' HB3' HG23 ' A' ' 115' ' ' VAL . 51.1 tp -61.1 -39.52 90.26 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.355 -0.839 . . . . 75.35 111.464 177.39 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.65 -43.52 96.52 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.906 0.483 . . . . 73.03 111.396 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -56.29 -47.56 78.41 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 123.993 0.808 . . . . 53.32 110.612 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.55 ' HB3' HD22 ' A' ' 104' ' ' LEU . 27.2 mm-40 -62.14 -44.98 95.43 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.754 0.822 . . . . 65.34 113.09 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.422 HG21 HD21 ' A' ' 77' ' ' LEU . 81.3 mt -65.13 -49.93 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.255 0.622 . . . . 75.21 110.863 -177.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -69.56 -26.21 64.38 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 111.988 0.366 . . . . 74.1 111.988 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.8 tp -72.5 -60.09 2.4 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 122.993 0.517 . . . . 63.44 111.268 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -81.35 -21.57 39.03 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.765 -0.652 . . . . 70.22 111.398 -171.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.521 ' SG ' HG23 ' A' ' 97' ' ' ILE . 60.1 m -124.44 92.73 47.6 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 123.612 0.765 . . . . 74.24 109.472 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.03 -10.75 26.51 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 123.004 2.47 . . . . 73.13 113.337 -177.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.441 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -100.6 46.63 1.32 Allowed Glycine 0 C--N 1.348 1.244 0 C-N-CA 122.759 0.219 . . . . 32.21 112.721 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 94.8 t -122.26 125.34 72.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 123.742 0.817 . . . . 74.32 109.187 170.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -87.82 -42.43 12.56 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.76 0.424 . . . . 75.15 111.158 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.1 t -152.98 165.51 35.33 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.061 0.458 . . . . 52.23 111.272 -172.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.422 HD21 HG21 ' A' ' 67' ' ' ILE . 79.1 mt -128.62 130.02 46.7 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 124.61 1.164 . . . . 71.25 108.143 175.851 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.542 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.7 ttm -107.72 101.88 11.15 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.53 -1.285 . . . . 61.4 107.53 174.801 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.438 ' HB ' ' HB ' ' A' ' 48' ' ' ILE . 45.8 mm -83.55 100.69 7.31 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 108.221 -1.029 . . . . 63.34 108.221 -176.061 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -83.06 172.06 51.09 Favored Glycine 0 C--O 1.248 0.973 0 N-CA-C 109.715 -1.354 . . . . 72.32 109.715 174.412 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.523 ' HA ' ' HB2' ' A' ' 41' ' ' GLN . 10.9 p-10 -70.07 -51.76 29.29 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 110.122 -0.325 . . . . 74.11 110.122 -178.415 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -99.58 -39.82 8.12 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.229 0.612 . . . . 70.33 109.847 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -95.76 163.03 13.35 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.522 0.729 . . . . 74.35 111.67 -170.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.54 ' HB2' HD11 ' A' ' 40' ' ' LEU . 67.3 tp -130.03 113.42 14.53 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.747 -0.834 . . . . 64.44 108.747 175.255 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.542 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 51.3 m -105.69 109.93 22.06 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.207 -0.664 . . . . 63.25 109.207 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.419 HG13 HG21 ' A' ' 101' ' ' ILE . 28.9 mm -87.83 133.76 29.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 107.77 -1.196 . . . . 74.31 107.77 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -114.44 134.0 55.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.417 0.687 . . . . 72.02 109.32 -177.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.457 ' NZ ' HD12 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -140.07 174.6 10.35 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.432 0.634 . . . . 75.02 111.426 175.285 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -86.49 147.73 25.85 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.917 -1.038 . . . . 70.03 109.08 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.6 ptt180 -76.81 -1.94 30.75 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 112.826 0.676 . . . . 75.21 112.826 -173.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 66.9 mtt -79.35 -24.49 42.68 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 109.854 -0.424 . . . . 73.21 109.854 172.63 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.441 HG11 ' HA3' ' A' ' 73' ' ' GLY . 60.1 t -98.29 142.27 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.909 0.883 . . . . 55.12 108.717 177.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -88.82 142.35 27.74 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.864 0.866 . . . . 74.31 111.556 -175.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.407 ' CD2' ' HE2' ' A' ' 88' ' ' LYS . 52.7 m95 -71.54 -45.37 62.51 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.967 0.507 . . . . 71.51 111.064 172.85 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -50.44 -32.21 17.22 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 124.56 1.144 . . . . 74.32 112.572 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.4 m -73.97 -54.32 8.16 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-N 115.467 -0.788 . . . . 75.04 110.839 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.521 HG23 ' SG ' ' A' ' 71' ' ' CYS . 10.5 mt -81.33 -22.4 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 124.318 1.047 . . . . 75.03 112.376 -170.745 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.69 -50.57 84.7 Favored Pre-proline 0 CA--C 1.557 1.246 0 C-N-CA 124.316 1.046 . . . . 74.41 113.512 -168.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -62.3 -28.44 78.85 Favored 'Trans proline' 0 C--N 1.385 2.49 0 C-N-CA 121.564 1.509 . . . . 65.33 111.97 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -70.68 -40.31 73.02 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.973 0.909 . . . . 71.04 111.219 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.419 HG21 HG13 ' A' ' 86' ' ' ILE . 71.4 mt -68.99 -45.9 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 N-CA-C 109.811 -0.44 . . . . 73.45 109.811 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.448 HG23 ' HB ' ' A' ' 19' ' ' ILE . 88.4 mt -53.57 -40.63 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.585 0.754 . . . . 54.12 110.597 175.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -74.37 -37.57 63.41 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.523 -0.762 . . . . 43.0 111.505 -179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.55 HD22 ' HB3' ' A' ' 66' ' ' GLN . 48.8 mt -64.75 -33.43 75.96 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.662 0.785 . . . . 64.31 111.6 175.031 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.36 -25.03 62.2 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.716 -0.675 . . . . 74.34 110.275 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 26.0 m -79.85 -33.76 39.91 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 109.05 -0.722 . . . . 63.51 109.05 176.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -64.67 -50.57 66.52 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.285 0.634 . . . . 74.42 111.08 175.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.519 ' HG3' ' HB2' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -68.16 -56.13 9.87 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.98 0.912 . . . . 75.25 110.431 -173.216 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 113' ' ' GLU . 66.9 mt -67.76 -11.96 59.54 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.679 0.792 . . . . 62.11 112.527 -173.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.07 -39.59 93.44 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.263 0.625 . . . . 60.22 110.386 173.273 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -94.26 -37.7 11.39 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.488 -0.778 . . . . 71.21 110.516 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.55 160.33 26.92 Favored Glycine 0 C--N 1.349 1.295 0 N-CA-C 114.243 0.457 . . . . 41.11 114.243 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.472 ' HA ' HD23 ' A' ' 109' ' ' LEU . 0.2 OUTLIER -86.29 -16.98 35.82 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.429 1.092 . . . . 74.33 111.604 179.904 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -67.3 107.95 2.57 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.345 0.658 . . . . 51.24 111.262 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.583 HG23 ' HB3' ' A' ' 63' ' ' LEU . 2.9 p . . . . . 0 CA--C 1.555 1.153 0 CA-C-N 115.459 -0.791 . . . . 74.2 109.91 170.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.58 HG21 ' HB2' ' A' ' 109' ' ' LEU . 1.6 mp . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 107.328 -1.36 . . . . 64.12 107.328 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -67.65 131.73 46.15 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.284 -0.871 . . . . 73.32 109.224 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.559 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.7 mm -112.78 124.9 69.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 N-CA-C 105.975 -1.861 . . . . 61.21 105.975 -178.93 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HD3' HD23 ' A' ' 33' ' ' LEU . 51.3 tttp -90.75 159.7 16.19 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.318 -1.364 . . . . 71.25 107.318 -179.097 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.499 HG21 ' HE3' ' A' ' 98' ' ' LYS . 41.2 m -137.83 133.17 33.63 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.893 -0.78 . . . . 75.52 108.893 176.882 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.541 HD11 HD22 ' A' ' 33' ' ' LEU . 50.6 mt -117.48 139.23 51.2 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 107.474 -1.306 . . . . 51.44 107.474 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 62.5 p -69.98 155.79 40.06 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 122.64 0.376 . . . . 61.33 110.296 175.271 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.0 p -131.35 149.53 73.86 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 124.31 1.044 . . . . 61.32 108.94 -177.337 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.3 -9.61 26.31 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 122.538 2.158 . . . . 55.32 113.308 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.411 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 21.3 t-20 -101.02 128.33 47.1 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.42 0.688 . . . . 71.15 109.446 174.824 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -68.0 -35.87 79.04 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.544 1.137 . . . . 73.02 113.315 -175.679 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -78.43 -16.01 58.04 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.993 0.517 . . . . 62.24 111.111 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.437 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -102.23 151.44 22.21 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.823 0.849 . . . . 51.11 110.155 -178.189 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.9 tp -160.74 118.82 2.49 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 108.112 -1.07 . . . . 72.33 108.112 172.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -90.69 130.91 36.64 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 121.489 0.662 . . . . 53.53 110.531 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -104.13 119.62 39.35 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 107.249 -1.389 . . . . 74.52 107.249 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.541 HD22 HD11 ' A' ' 22' ' ' LEU . 23.6 tp -98.54 123.47 42.73 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.517 -0.92 . . . . 73.02 108.517 -172.228 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.4 m -90.53 105.78 18.05 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 108.47 -0.937 . . . . 73.45 108.47 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.5 t -136.83 8.06 3.0 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 115.745 -0.661 . . . . 70.53 111.416 -174.199 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -145.63 141.25 27.98 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.146 -1.057 . . . . 74.32 108.146 175.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.564 ' HA3' HG13 ' A' ' 17' ' ' ILE . . . 81.91 -90.05 1.45 Allowed Glycine 0 C--N 1.34 0.79 0 N-CA-C 110.816 -0.914 . . . . 65.54 110.816 -173.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -134.26 -179.59 5.66 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.128 0.971 . . . . 63.31 109.958 178.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 12.3 ptp -111.88 162.14 15.62 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.128 0.971 . . . . 70.34 108.422 161.561 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.418 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 74.4 mt -70.66 -38.71 73.83 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.783 0.833 . . . . 64.41 111.731 -175.05 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.728 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.6 tt0 . . . . . 0 CA--C 1.542 0.664 0 N-CA-C 107.735 -1.209 . . . . 75.32 107.735 -178.161 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.6 t . . . . . 0 CA--C 1.554 1.109 0 N-CA-C 110.064 -0.347 . . . . 73.23 110.064 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.4 178.61 5.56 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.597 1.159 . . . . 72.11 111.513 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 55.2 m -91.79 128.91 37.8 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.892 0.877 . . . . 53.45 109.818 173.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 mp -96.74 119.52 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 124.197 0.999 . . . . 75.24 109.016 -178.69 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -91.49 110.33 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 CA-C-N 118.447 0.567 . . . . 73.32 109.786 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.1 mt -101.95 109.74 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.46 1.104 . . . . 74.23 108.81 176.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -93.12 151.05 20.09 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.214 0.606 . . . . 73.5 109.882 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.469 ' HA ' HD11 ' A' ' 58' ' ' ILE . 47.3 p30 -66.95 -24.32 66.06 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.387 0.675 . . . . 73.54 112.137 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.8 t -84.52 -7.07 59.39 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.975 0.91 . . . . 60.02 112.008 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -111.66 88.7 2.86 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.272 0.629 . . . . 73.24 109.795 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.44 -35.26 51.85 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.273 1.029 . . . . 75.21 111.653 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -57.3 -53.39 58.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.511 1.124 . . . . 74.24 111.094 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.8 -34.41 78.28 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.417 -0.81 . . . . 71.2 111.231 -176.721 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.517 HG22 ' HG2' ' A' ' 65' ' ' GLN . 66.6 mt -70.09 -47.33 68.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.188 0.995 . . . . 74.03 110.217 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -62.29 -19.33 63.15 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.473 1.109 . . . . 53.43 112.683 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -69.25 -54.86 12.56 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-O 121.334 0.587 . . . . 74.33 109.732 172.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.3 m -94.67 107.82 19.81 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.103 -0.953 . . . . 72.22 110.478 -172.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 38.7 ttpt -59.1 -33.27 70.63 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.018 0.527 . . . . 73.24 109.741 174.519 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.417 HD11 HD12 ' A' ' 105' ' ' LEU . 30.6 tp -59.23 -46.52 88.25 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.619 1.167 . . . . 71.22 110.637 177.085 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.09 -47.02 84.49 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 123.85 0.86 . . . . 55.44 110.658 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.517 ' HG2' HG22 ' A' ' 58' ' ' ILE . 65.9 mt-30 -59.1 -39.94 83.77 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 124.58 1.175 . . . . 74.21 110.967 -178.795 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.547 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 87.3 mm-40 -66.73 -45.77 77.59 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 118.513 -0.756 . . . . 63.13 110.891 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -58.33 -43.61 86.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 CA-C-N 118.63 0.65 . . . . 63.13 110.68 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -68.58 -32.79 72.95 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.387 0.675 . . . . 74.41 111.342 175.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.6 tp -68.16 -34.8 76.99 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.439 0.696 . . . . 74.2 110.817 175.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.547 ' HG2' ' O ' ' A' ' 66' ' ' GLN . 7.1 mm100 -75.16 -41.31 58.4 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 120.983 0.421 . . . . 75.34 110.007 -178.77 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 61.0 m -151.43 100.57 2.97 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 124.136 0.974 . . . . 53.34 108.503 -176.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -67.25 1.95 2.61 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 123.381 2.721 . . . . 74.13 114.349 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.58 -5.42 89.92 Favored Glycine 0 C--N 1.352 1.457 0 CA-C-O 119.749 -0.473 . . . . 71.45 113.544 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.1 t -74.09 127.04 35.69 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 123.063 0.545 . . . . 74.45 110.243 177.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -84.79 -45.5 12.3 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.934 0.894 . . . . 54.32 110.874 -177.17 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.9 p -156.92 166.2 34.02 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.789 0.804 . . . . 71.04 110.923 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.1 mt -126.18 127.62 45.98 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 107.157 -1.423 . . . . 74.13 107.157 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.615 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.3 ttm -103.56 96.75 6.94 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 106.989 -1.485 . . . . 71.01 106.989 173.516 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 29.4 mm -77.88 101.01 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 114.893 -1.049 . . . . 51.4 108.685 -175.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.88 174.24 44.07 Favored Glycine 0 C--O 1.247 0.967 0 N-CA-C 110.31 -1.116 . . . . 64.14 110.31 176.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.728 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 2.5 m-20 -76.64 -56.67 4.4 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.791 0.805 . . . . 55.22 109.808 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -101.9 -7.79 22.15 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.474 -1.239 . . . . 65.13 111.114 -174.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -139.9 172.32 12.94 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.452 0.701 . . . . 74.55 110.654 -176.313 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.418 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 35.7 tp -143.75 106.93 4.52 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.872 0.469 . . . . 75.22 110.13 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.615 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 61.0 m -95.8 103.49 15.38 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.851 -0.796 . . . . 65.13 108.851 -176.346 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.632 HG13 HD13 ' A' ' 101' ' ' ILE . 15.7 mm -87.88 122.55 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.554 -0.906 . . . . 72.01 108.554 -177.101 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -108.35 113.57 26.75 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 108.153 -1.054 . . . . 74.13 108.153 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.74 177.55 5.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.45 0.7 . . . . 74.43 110.446 -175.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -77.16 136.85 38.61 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.184 0.593 . . . . 75.03 110.109 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -67.74 -22.18 65.24 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 112.86 0.689 . . . . 70.44 112.86 -171.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 71.8 mtm -79.81 -22.89 42.51 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.866 0.466 . . . . 54.15 110.888 176.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 38.5 t -89.56 141.72 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.028 -1.101 . . . . 73.54 108.028 176.681 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 68.7 m80 -110.9 157.24 20.09 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.612 0.597 . . . . 74.32 112.612 -171.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -70.74 -25.22 62.83 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.19 0.996 . . . . 71.24 112.93 -176.423 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -59.2 -24.87 63.48 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 120.977 0.417 . . . . 71.52 111.043 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 17.8 m -88.87 -42.29 11.94 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.283 1.033 . . . . 74.35 111.739 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.517 HG22 HD11 ' A' ' 101' ' ' ILE . 7.6 mt -91.33 -50.02 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 122.905 0.482 . . . . 72.34 111.039 -165.602 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.499 ' HE3' HG21 ' A' ' 21' ' ' THR . 85.8 tttt -50.95 -51.36 67.96 Favored Pre-proline 0 CA--C 1.566 1.561 0 N-CA-C 114.509 1.3 . . . . 74.31 114.509 -174.526 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -57.26 -35.15 98.85 Favored 'Trans proline' 0 C--N 1.398 3.143 0 C-N-CA 121.884 1.723 . . . . 73.52 112.147 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.427 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 26.0 mm-40 -67.53 -46.02 74.01 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.159 -0.928 . . . . 73.24 110.268 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.632 HD13 HG13 ' A' ' 86' ' ' ILE . 76.7 mt -61.53 -47.11 94.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.611 0.764 . . . . 50.35 110.565 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.559 HG23 ' HB ' ' A' ' 19' ' ' ILE . 76.8 mt -57.86 -45.55 87.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 123.659 0.599 . . . . 74.41 110.25 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -59.37 -48.0 83.3 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.851 0.86 . . . . 74.3 111.273 178.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 95.7 mt -62.88 -40.0 96.18 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.033 0.933 . . . . 73.31 111.726 -178.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.417 HD12 HD11 ' A' ' 63' ' ' LEU . 9.4 mp -71.74 -27.9 63.31 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.758 0.823 . . . . 70.4 110.933 178.453 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 97.5 m -74.25 -47.01 37.89 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.922 0.489 . . . . 74.34 109.775 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -76.15 -34.6 59.4 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.399 -0.819 . . . . 73.32 111.357 -174.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.665 ' HG3' ' HB2' ' A' ' 113' ' ' GLU . 30.8 tt0 -59.31 -55.34 36.09 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.92 0.488 . . . . 63.15 109.997 175.877 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.58 ' HB2' HG21 ' A' ' 17' ' ' ILE . 80.9 mt -73.43 -16.95 61.3 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.299 -0.864 . . . . 65.32 111.119 -175.266 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.35 -46.3 70.51 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.347 0.659 . . . . 72.04 110.407 171.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.499 ' HB2' ' HG3' ' A' ' 113' ' ' GLU . 18.8 m-85 -73.79 -19.22 60.83 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 115.963 -0.562 . . . . 73.02 110.155 173.678 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.57 44.4 26.7 Favored Glycine 0 C--N 1.35 1.358 0 N-CA-C 111.584 -0.607 . . . . 74.34 111.584 -179.084 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.665 ' HB2' ' HG3' ' A' ' 108' ' ' GLN . 44.0 mt-10 -88.69 174.9 7.76 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.747 0.819 . . . . 55.32 111.25 -177.667 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -109.85 128.21 55.19 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 124.685 1.194 . . . . 73.41 108.928 -178.321 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 CA--C 1.546 0.802 0 N-CA-C 107.591 -1.262 . . . . 71.24 107.591 165.378 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.415 ' O ' HG12 ' A' ' 19' ' ' ILE . 67.6 mt . . . . . 0 C--O 1.238 0.468 0 N-CA-C 107.357 -1.349 . . . . 74.51 107.357 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -67.51 105.42 1.83 Allowed 'General case' 0 C--O 1.241 0.644 0 CA-C-O 121.494 0.664 . . . . 75.32 110.25 -171.613 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 17' ' ' ILE . 49.8 mm -118.79 109.95 28.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 N-CA-C 106.378 -1.712 . . . . 74.2 106.378 -176.826 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -92.87 119.48 32.23 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 108.678 -0.86 . . . . 74.51 108.678 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.9 t -92.55 118.79 31.37 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.734 -0.839 . . . . 62.22 108.734 -178.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.4 mt -124.58 140.7 52.7 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.331 1.052 . . . . 71.33 109.19 -173.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 17.9 p -82.09 152.96 26.33 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 122.77 0.428 . . . . 70.4 110.595 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.7 p -114.4 169.94 6.01 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.119 0.968 . . . . 63.13 108.645 -178.623 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -59.63 -12.22 16.92 Favored 'Trans proline' 0 C--N 1.381 2.252 0 C-N-CA 122.487 2.124 . . . . 62.21 113.598 168.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.494 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 84.0 m-20 -95.0 151.49 19.12 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.203 1.001 . . . . 64.41 110.701 176.54 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -82.86 -45.26 14.46 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.265 0.626 . . . . 71.13 109.966 174.368 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -92.52 29.95 1.62 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.067 0.947 . . . . 64.22 111.048 -174.808 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -139.45 127.6 22.49 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.9 0.88 . . . . 74.53 108.769 171.213 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.9 tp -129.1 125.64 37.61 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.869 -1.159 . . . . 70.33 107.869 174.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -82.62 133.05 35.18 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.094 0.958 . . . . 73.51 110.588 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -117.01 122.96 45.71 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 107.885 -1.154 . . . . 73.21 107.885 171.057 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.7 tp -118.31 130.56 56.1 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.422 0.689 . . . . 73.0 111.099 -169.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 p -90.11 120.95 31.73 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 108.538 -0.912 . . . . 73.24 108.538 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 60.0 p -108.9 -26.95 9.97 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 113.669 0.988 . . . . 75.21 113.669 -164.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -72.32 -37.65 68.86 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 118.113 0.415 . . . . 74.41 110.599 -175.045 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 157.18 1.24 0.1 OUTLIER Glycine 0 C--N 1.345 1.037 0 CA-C-O 119.514 -0.604 . . . . 34.32 114.218 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.524 ' HB3' HD22 ' A' ' 109' ' ' LEU . 18.6 mp0 -79.77 84.84 5.51 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.365 0.666 . . . . 74.3 110.879 -171.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 79.7 mtp -77.72 124.81 28.43 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.118 0.485 . . . . 75.01 110.457 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.585 ' HB3' HG12 ' A' ' 115' ' ' VAL . 95.6 mt -65.64 -33.23 75.41 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 125.142 1.377 . . . . 71.11 112.209 -177.469 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.576 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 29.1 tt0 . . . . . 0 CA--C 1.544 0.728 0 C-N-CA 124.81 1.244 . . . . 74.11 107.76 -174.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 63.8 m . . . . . 0 CA--C 1.539 0.549 0 N-CA-C 109.157 -0.682 . . . . 54.41 109.157 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -62.12 145.88 52.08 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.014 0.526 . . . . 74.33 111.665 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.1 m -63.05 113.09 2.91 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.107 0.963 . . . . 73.21 111.441 -174.248 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.6 mt -80.85 116.1 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 123.607 0.763 . . . . 70.22 110.365 -174.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 64.4 t -91.55 108.26 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 N-CA-C 109.082 -0.71 . . . . 64.44 109.082 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.416 ' HB ' ' HB2' ' A' ' 77' ' ' LEU . 73.3 mt -96.45 110.28 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 108.066 -1.087 . . . . 63.43 108.066 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.4 mtmp? -92.52 161.66 14.53 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.869 0.467 . . . . 74.05 110.279 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.9 p30 -65.58 -25.82 67.57 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 113.736 1.013 . . . . 74.11 113.736 -175.059 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.0 p -84.9 -12.1 54.15 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.384 0.274 . . . . 62.04 111.462 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -82.89 68.97 9.59 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.32 0.648 . . . . 73.45 110.043 -177.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -49.26 -39.33 30.09 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.504 1.522 . . . . 71.22 111.648 176.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 39.6 t-20 -60.23 -50.13 74.89 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.568 1.147 . . . . 63.15 110.568 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 71.2 mt -74.73 -28.93 60.99 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.855 0.462 . . . . 55.1 111.559 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 82.8 mt -67.14 -49.2 75.19 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 N-CA-C 109.224 -0.658 . . . . 61.11 109.224 174.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -66.54 -24.42 66.37 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.121 0.415 . . . . 63.52 112.121 177.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -79.77 -24.74 41.31 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 112.022 0.379 . . . . 60.52 112.022 175.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.9 t -114.97 108.52 16.81 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 109.747 -0.464 . . . . 73.43 109.747 177.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -64.54 -31.64 72.94 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.057 0.543 . . . . 63.15 110.778 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.524 ' HB2' ' NE2' ' A' ' 108' ' ' GLN . 58.6 tp -60.74 -41.63 95.77 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.517 0.727 . . . . 72.13 110.599 173.578 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -57.65 -47.39 82.4 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.837 0.455 . . . . 42.52 110.459 177.763 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -59.17 -44.77 92.16 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.077 -0.965 . . . . 70.23 110.571 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -59.75 -53.33 59.22 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.811 0.844 . . . . 71.12 112.488 177.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.689 HG22 HG21 ' A' ' 74' ' ' VAL . 59.6 mt -65.51 -39.82 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 123.084 0.554 . . . . 63.25 111.143 -174.645 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -66.78 -31.03 71.4 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.337 0.655 . . . . 74.14 111.51 174.367 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.3 tp -70.85 -52.78 18.22 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.872 0.469 . . . . 72.35 110.744 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -69.79 -29.23 66.49 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.321 -0.854 . . . . 74.21 110.894 -174.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.628 ' SG ' HG23 ' A' ' 97' ' ' ILE . 82.3 m -144.61 96.33 5.2 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 108.884 -0.784 . . . . 54.25 108.884 176.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -63.87 -4.57 7.54 Favored 'Trans proline' 0 N--CA 1.5 1.911 0 C-N-CA 123.276 2.651 . . . . 73.24 114.315 175.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.523 ' HA3' HG21 ' A' ' 92' ' ' VAL . . . -86.99 8.64 75.56 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-O 119.555 -0.581 . . . . 70.23 113.794 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.689 HG21 HG22 ' A' ' 67' ' ' ILE . 99.9 t -69.79 124.74 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.192 0.597 . . . . 64.31 110.073 173.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.05 -56.6 3.39 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.905 -0.776 . . . . 72.5 108.905 -179.086 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 61.1 m -147.74 167.92 23.43 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 115.768 -0.651 . . . . 61.32 110.891 -178.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.416 ' HB2' ' HB ' ' A' ' 50' ' ' ILE . 77.3 mt -127.16 148.54 50.17 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.535 1.134 . . . . 71.55 109.097 176.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.539 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.0 ttm -126.17 111.02 14.13 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 108.051 -1.092 . . . . 54.55 108.051 169.094 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.0 mm -89.35 103.01 13.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 108.37 -0.974 . . . . 71.44 108.37 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.9 176.81 41.22 Favored Glycine 0 C--O 1.243 0.671 0 N-CA-C 111.5 -0.64 . . . . 75.14 111.5 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.576 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 3.9 m-20 -69.96 -60.28 2.4 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.737 0.779 . . . . 61.41 109.611 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.23 -17.28 14.52 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.82 -1.082 . . . . 72.04 110.302 -177.648 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -118.63 167.99 11.12 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.363 0.665 . . . . 73.03 111.556 -171.338 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 31.8 tp -141.3 142.59 33.85 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.512 0.725 . . . . 75.44 109.326 175.628 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.539 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 86.8 m -131.03 118.15 20.17 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.289 0.636 . . . . 64.12 109.685 174.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 19.7 mm -108.77 108.17 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 109.922 -0.399 . . . . 63.25 109.922 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -83.15 146.62 28.54 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.382 0.673 . . . . 71.21 110.53 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.776 ' HE2' HG21 ' A' ' 97' ' ' ILE . 34.6 mmtm -123.51 171.59 9.39 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.893 0.877 . . . . 72.01 110.322 173.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.65 149.13 32.94 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.891 -1.151 . . . . 62.43 107.891 163.301 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -62.79 -24.44 67.74 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.432 0.693 . . . . 73.23 112.599 -175.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 21.5 ptm -73.13 -18.79 61.25 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.059 0.544 . . . . 50.4 111.822 -177.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.523 HG21 ' HA3' ' A' ' 73' ' ' GLY . 8.5 t -100.98 137.14 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.64 0.776 . . . . 63.2 109.811 -175.085 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -97.76 148.52 23.28 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.541 0.736 . . . . 73.14 111.733 -174.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -74.41 -36.43 63.47 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.941 1.296 . . . . 75.53 113.306 -173.693 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -52.57 -29.04 23.58 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.333 1.053 . . . . 60.5 113.241 -173.325 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.7 p -83.07 -36.51 24.84 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.399 0.68 . . . . 74.33 110.676 -178.612 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.776 HG21 ' HE2' ' A' ' 88' ' ' LYS . 48.2 mt -89.6 -29.53 5.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 CA-C-N 115.118 -0.946 . . . . 72.14 112.196 -164.198 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -53.3 -53.43 56.23 Favored Pre-proline 0 CA--C 1.562 1.426 0 CA-C-O 117.766 -1.111 . . . . 72.42 112.546 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.87 -31.94 94.56 Favored 'Trans proline' 0 C--N 1.395 3.015 0 C-N-CA 121.927 1.752 . . . . 72.45 112.51 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -64.01 -52.75 58.06 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.37 0.419 . . . . 71.44 111.272 177.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 67.5 mt -66.58 -43.7 90.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 122.989 0.515 . . . . 73.45 110.828 -176.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 93.5 mt -58.54 -40.41 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 122.89 0.476 . . . . 64.32 110.49 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.17 -46.99 75.45 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 123.326 0.391 . . . . 71.43 111.046 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.1 mt -62.31 -34.88 77.46 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.526 0.73 . . . . 73.42 111.469 -179.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.66 -35.43 70.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.46 0.704 . . . . 72.22 110.555 175.622 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 92.3 m -72.9 -32.75 65.57 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.638 -0.504 . . . . 64.52 109.638 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -66.7 -57.2 7.62 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.573 0.749 . . . . 72.2 110.129 174.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.524 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 26.2 tt0 -53.28 -55.58 23.5 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.062 0.945 . . . . 75.42 111.637 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 38' ' ' GLU . 76.8 mt -68.87 -15.85 63.61 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 124.162 0.914 . . . . 63.35 111.609 -174.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -80.34 -20.44 44.19 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.292 0.637 . . . . 50.24 111.628 175.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -100.93 -28.19 12.89 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.217 0.607 . . . . 74.02 110.664 175.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.14 140.96 3.66 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.898 -0.592 . . . . 65.44 111.805 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -59.69 -33.83 72.1 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.898 0.879 . . . . 74.53 111.857 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -75.77 133.52 40.68 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.344 0.592 . . . . 74.54 111.822 -173.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.585 HG12 ' HB3' ' A' ' 40' ' ' LEU . 3.1 p . . . . . 0 N--CA 1.467 0.403 0 N-CA-C 107.889 -1.152 . . . . 62.52 107.889 158.078 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.532 ' HB ' HG23 ' A' ' 106' ' ' THR . 93.0 mt . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 109.745 -0.465 . . . . 64.31 109.745 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -84.67 135.46 34.15 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.1 0.56 . . . . 63.2 110.028 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.54 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.7 mm -128.78 122.23 56.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 107.522 -1.288 . . . . 60.41 107.522 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -101.6 125.44 48.26 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.288 1.035 . . . . 72.22 108.629 -176.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' THR . . . . . 0.545 HG21 ' HE3' ' A' ' 98' ' ' LYS . 28.8 m -105.53 111.22 23.84 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.594 -0.891 . . . . 64.43 108.594 -179.189 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.0 mt -100.43 139.35 36.23 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.966 0.906 . . . . 73.12 111.112 -174.514 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.2 p -70.48 130.4 41.77 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 124.372 1.045 . . . . 64.13 110.165 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 43.5 p -118.21 152.76 51.03 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 123.177 0.591 . . . . 63.31 110.185 -174.62 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.86 8.33 3.49 Favored 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 122.911 2.407 . . . . 64.45 112.615 172.299 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -90.42 123.57 34.25 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.333 1.053 . . . . 73.42 109.073 -178.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.509 ' HG2' HD22 ' A' ' 28' ' ' ASN . 45.5 tt0 -77.87 130.77 37.04 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.399 0.68 . . . . 74.24 110.731 -177.621 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.509 HD22 ' HG2' ' A' ' 27' ' ' GLU . 51.2 m-80 59.1 25.11 13.51 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.637 1.175 . . . . 71.15 112.263 -173.718 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.507 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -142.02 139.48 32.37 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.382 0.673 . . . . 72.11 109.686 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.4 tp -148.34 138.04 22.25 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.733 0.413 . . . . 72.31 110.555 -173.324 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -85.9 123.78 31.63 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.374 0.669 . . . . 75.22 111.814 -174.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -110.34 110.6 21.45 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 107.174 -1.417 . . . . 51.41 107.174 170.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.3 tp -106.08 129.62 54.14 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.331 1.052 . . . . 70.45 110.24 -167.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.9 m -77.51 104.99 8.36 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.995 -0.743 . . . . 72.12 108.995 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.5 p -113.09 10.56 18.73 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.552 0.741 . . . . 64.25 111.278 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -75.34 -26.7 58.8 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.379 0.672 . . . . 64.44 110.902 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.71 -36.96 1.92 Allowed Glycine 0 C--N 1.334 0.419 0 N-CA-C 110.395 -1.082 . . . . 70.43 110.395 -176.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -78.2 161.41 27.34 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 122.026 0.917 . . . . 74.04 111.446 174.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 85.0 mtp -117.97 142.53 47.26 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 106.376 -1.713 . . . . 62.33 106.376 170.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 82.5 mt -55.29 -45.22 76.24 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.842 0.457 . . . . 71.04 112.021 -175.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 . . . . . 0 C--O 1.243 0.737 0 C-N-CA 124.333 1.053 . . . . 75.25 108.789 -177.025 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 121.27 0.557 . . . . 75.4 111.009 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -120.05 178.02 4.77 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 108.115 -1.069 . . . . 53.23 108.115 168.267 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.1 p -87.87 71.8 9.44 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.603 -1.258 . . . . 64.34 107.603 167.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.568 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 55.9 mt -72.42 104.49 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 115.323 -0.853 . . . . 51.21 109.817 -167.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 77' ' ' LEU . 60.2 t -87.63 109.59 19.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.806 -0.813 . . . . 53.04 108.806 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.442 HG23 ' HB2' ' A' ' 57' ' ' LEU . 52.5 mt -109.41 112.37 40.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 108.674 -0.862 . . . . 71.12 108.674 178.522 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.5 mtpt -86.47 162.01 18.31 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 109.39 -0.596 . . . . 73.42 109.39 173.202 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.8 p-10 -59.06 -24.75 63.15 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.41 1.084 . . . . 72.24 112.332 178.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.1 t -81.63 -18.23 45.39 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.073 0.549 . . . . 52.13 111.196 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.0 68.28 7.23 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.971 0.908 . . . . 73.22 111.115 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -60.02 -27.27 66.76 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.453 0.701 . . . . 73.32 110.994 176.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -60.37 -40.21 90.02 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 122.927 0.491 . . . . 72.12 111.355 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.442 ' HB2' HG23 ' A' ' 50' ' ' ILE . 87.1 mt -81.24 -35.7 30.88 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.808 0.843 . . . . 60.1 111.748 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 83.0 mt -63.22 -35.09 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.771 0.828 . . . . 44.4 109.836 176.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -63.02 -28.1 69.87 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.755 1.222 . . . . 42.15 111.663 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -82.02 -7.35 59.61 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.48 0.712 . . . . 72.31 111.926 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.2 t -135.74 101.77 4.87 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.895 0.478 . . . . 73.33 111.013 -171.08 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -54.76 -36.32 64.73 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.241 0.616 . . . . 52.14 110.648 170.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.567 ' HB2' ' HG3' ' A' ' 108' ' ' GLN . 27.2 tp -63.61 -44.08 95.0 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.261 0.624 . . . . 73.02 111.155 177.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.03 98.07 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.901 0.48 . . . . 55.33 111.099 179.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -54.43 -48.41 71.69 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 124.144 0.902 . . . . 53.14 110.475 175.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.544 ' HB3' HD22 ' A' ' 104' ' ' LEU . 27.9 mm-40 -63.68 -41.08 98.2 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.167 0.987 . . . . 73.35 113.101 178.405 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.544 HG21 HD21 ' A' ' 77' ' ' LEU . 95.9 mt -64.68 -53.22 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.472 0.709 . . . . 72.34 111.164 -178.239 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -68.49 -27.75 66.4 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 123.415 0.447 . . . . 71.5 111.416 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -66.55 -58.58 4.9 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.182 0.593 . . . . 54.14 110.739 177.008 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.467 ' NE2' HD21 ' A' ' 104' ' ' LEU . 78.7 mt-30 -79.21 -26.59 42.55 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.765 -0.652 . . . . 62.05 112.139 -174.057 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 79.5 m -133.08 86.85 41.29 Favored Pre-proline 0 CA--C 1.548 0.891 0 N-CA-C 108.904 -0.776 . . . . 62.13 108.904 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.88 -7.08 19.56 Favored 'Trans proline' 0 C--N 1.369 1.641 0 C-N-CA 122.933 2.422 . . . . 65.23 112.644 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.23 -15.28 81.71 Favored Glycine 0 C--N 1.347 1.19 0 CA-C-N 116.221 -0.445 . . . . 65.14 113.138 178.249 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 68.0 t -73.39 121.8 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 108.683 -0.858 . . . . 52.1 108.683 174.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -90.95 -28.67 17.9 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 115.9 -0.591 . . . . 71.22 110.904 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.7 t -161.65 161.63 29.63 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.591 0.71 . . . . 73.04 111.536 -171.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.544 HD21 HG21 ' A' ' 67' ' ' ILE . 84.6 mt -126.06 150.94 47.78 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.734 1.214 . . . . 75.1 108.228 177.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.575 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.3 ttm -125.01 104.15 8.4 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.028 -1.471 . . . . 73.21 107.028 168.084 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.714 HD13 HD13 ' A' ' 84' ' ' LEU . 34.2 mm -86.82 132.76 31.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.524 -0.917 . . . . 72.24 108.524 -175.436 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -121.14 -170.58 14.05 Favored Glycine 0 C--O 1.245 0.834 0 N-CA-C 110.901 -0.88 . . . . 53.22 110.901 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.02 -55.06 16.05 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.04 0.924 . . . . 74.53 109.707 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -118.03 0.98 11.96 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.513 -1.221 . . . . 74.23 111.705 -172.066 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -140.52 166.26 25.21 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.351 0.596 . . . . 73.44 111.661 -170.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.714 HD13 HD13 ' A' ' 79' ' ' ILE . 17.3 tp -141.65 116.56 9.86 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 114.368 -1.287 . . . . 53.23 108.601 176.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.575 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 14.1 m -100.61 111.56 23.82 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.261 -1.015 . . . . 74.01 108.261 179.575 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 29' ' ' ALA . 43.2 mm -86.31 125.88 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 109.244 -0.65 . . . . 73.33 109.244 -174.517 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -110.57 118.7 36.94 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 107.976 -1.12 . . . . 65.45 107.976 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -130.37 170.86 13.6 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 120.953 0.406 . . . . 71.34 111.205 -174.075 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.417 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 16.6 t70 -71.7 148.99 45.89 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 115.092 -0.958 . . . . 74.33 110.638 174.754 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 18.1 ptp180 -62.69 -24.11 67.48 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.309 1.044 . . . . 74.02 113.03 -175.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 86.8 mtp -80.11 -14.75 58.26 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.847 0.459 . . . . 72.33 111.784 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.84 124.09 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.543 0.737 . . . . 62.0 109.262 -175.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -89.18 142.47 27.62 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.489 0.716 . . . . 62.55 110.749 -172.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -58.81 -33.75 70.73 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.832 0.853 . . . . 73.35 112.442 178.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -61.62 -23.59 66.14 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.206 0.602 . . . . 52.03 112.277 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 26.5 m -91.61 -17.89 24.86 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.463 0.705 . . . . 74.25 111.849 177.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 87.1 mt -96.29 -50.8 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.894 0.878 . . . . 74.23 111.198 -171.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.545 ' HE3' HG21 ' A' ' 21' ' ' THR . 57.7 mtpt -56.15 -57.51 22.0 Favored Pre-proline 0 CA--C 1.551 0.988 0 CA-C-O 117.436 -1.269 . . . . 74.33 113.565 -167.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -59.59 -36.51 92.4 Favored 'Trans proline' 0 C--N 1.395 2.999 0 C-N-CA 121.978 1.786 . . . . 60.12 111.842 -174.36 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 6.3 mm-40 -66.59 -49.83 65.05 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 114.917 -1.038 . . . . 65.44 110.928 -177.378 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 24.4 mt -75.48 -29.88 21.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 C-N-CA 123.209 0.604 . . . . 70.23 111.502 -175.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.54 HG23 ' HB ' ' A' ' 19' ' ' ILE . 93.7 mt -60.2 -42.54 90.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-O 121.108 0.48 . . . . 73.01 109.795 170.442 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -63.63 -40.06 95.92 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 114.926 -1.034 . . . . 72.41 110.852 176.39 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.544 HD22 ' HB3' ' A' ' 66' ' ' GLN . 98.5 mt -66.57 -38.37 86.91 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.622 0.769 . . . . 73.23 112.53 178.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.6 HD11 HD23 ' A' ' 84' ' ' LEU . 10.0 mp -65.38 -24.24 67.17 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.621 0.369 . . . . 41.44 110.802 174.575 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.532 HG23 ' HB ' ' A' ' 17' ' ' ILE . 89.2 m -81.69 -37.16 27.82 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.569 0.747 . . . . 72.05 109.612 177.258 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -63.21 -46.62 86.17 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.436 0.695 . . . . 70.1 111.138 175.321 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.567 ' HG3' ' HB2' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -64.09 -56.97 11.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.002 0.921 . . . . 65.11 110.3 -175.027 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.488 ' HB2' HD13 ' A' ' 17' ' ' ILE . 97.1 mt -68.54 -12.63 61.54 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 115.761 -0.654 . . . . 63.44 112.279 -176.292 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -88.06 -49.54 6.97 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.863 0.465 . . . . 74.44 111.268 174.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -92.49 -16.53 25.68 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.649 0.379 . . . . 75.13 111.855 -170.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -134.13 -135.66 3.57 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 110.893 -0.883 . . . . 41.05 110.893 -178.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -160.85 -60.18 0.06 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.613 0.765 . . . . 64.12 110.071 -175.594 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -92.44 141.9 28.02 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.738 0.815 . . . . 43.43 110.087 -178.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.505 HG21 HD12 ' A' ' 79' ' ' ILE . 6.0 p . . . . . 0 C--O 1.215 -0.711 0 N-CA-C 108.573 -0.899 . . . . 64.11 108.573 168.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.403 HG13 ' HB2' ' A' ' 109' ' ' LEU . 11.6 mm . . . . . 0 N--CA 1.471 0.61 0 CA-C-O 119.589 -0.243 . . . . 73.14 110.557 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' HIS . . . . . 0.488 ' HB2' ' O ' ' A' ' 35' ' ' THR . 5.0 m170 -87.89 138.05 31.79 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 107.728 -1.212 . . . . 72.02 107.728 174.238 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.521 ' HB ' HG23 ' A' ' 102' ' ' ILE . 51.4 mm -123.06 116.45 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 107.848 -1.168 . . . . 62.5 107.848 -176.053 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.606 ' HE3' HD21 ' A' ' 22' ' ' LEU . 62.6 tttp -100.12 125.77 46.27 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.167 1.387 . . . . 72.24 108.955 -172.493 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 89.5 m -93.77 112.01 23.8 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.679 -0.86 . . . . 63.52 108.679 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.606 HD21 ' HE3' ' A' ' 20' ' ' LYS . 93.9 mt -106.31 136.59 45.77 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 123.737 0.815 . . . . 75.24 109.49 177.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 34.6 p -89.16 143.25 26.98 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.635 0.774 . . . . 71.42 110.405 179.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.7 p -119.98 154.24 55.42 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 124.377 1.071 . . . . 74.23 109.278 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -49.7 -45.97 29.27 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 123.571 2.847 . . . . 74.11 113.244 176.069 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -77.85 114.99 17.25 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.818 0.847 . . . . 71.25 109.145 175.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.38 -19.35 59.6 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.864 0.466 . . . . 50.33 111.436 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -63.42 -27.18 69.12 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.914 0.886 . . . . 74.44 109.612 172.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.413 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -102.37 154.06 19.43 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.056 1.342 . . . . 75.42 110.94 176.442 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 tp -151.07 127.82 10.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.683 0.793 . . . . 70.15 108.884 170.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -90.17 138.19 31.73 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.326 0.65 . . . . 74.24 111.729 -174.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -123.49 126.25 46.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.699 1.2 . . . . 74.13 108.638 171.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.6 tp -117.05 125.72 51.76 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.269 1.027 . . . . 73.41 108.656 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.4 p -80.59 107.07 13.09 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 108.848 -0.797 . . . . 71.12 108.848 176.448 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' THR . . . . . 0.488 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 26.0 p -106.87 127.43 53.41 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.009 1.324 . . . . 71.52 108.638 -177.894 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 57.99 73.79 0.45 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.349 1.06 . . . . 75.43 109.943 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -175.82 -130.05 1.28 Allowed Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 114.277 -1.328 . . . . 34.24 110.474 -176.636 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -129.4 156.26 44.36 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.818 0.847 . . . . 73.2 109.753 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 15.7 ttt -78.4 144.99 35.4 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.489 0.716 . . . . 61.13 110.776 -171.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' A' ' 84' ' ' LEU . 96.3 mt -70.73 -39.27 73.47 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.52 0.728 . . . . 71.04 112.2 -175.345 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.544 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.9 tp-100 . . . . . 0 CA--C 1.539 0.537 0 C-N-CA 123.949 0.899 . . . . 74.54 109.031 -176.254 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.7 m . . . . . 0 N--CA 1.477 0.916 0 CA-C-O 120.924 0.392 . . . . 63.25 111.678 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -94.99 -172.95 2.83 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.217 1.007 . . . . 75.03 109.881 175.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.6 p -72.56 101.26 2.95 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.542 0.737 . . . . 73.34 110.189 174.316 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 53.9 mt -78.51 102.53 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.445 0.698 . . . . 73.15 109.72 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 40.5 t -90.19 108.71 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 N-CA-C 109.036 -0.728 . . . . 54.45 109.036 -176.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 72.2 mt -98.36 109.14 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 N-CA-C 108.593 -0.891 . . . . 61.44 108.593 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -103.55 141.01 36.75 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.0 0.52 . . . . 73.22 110.007 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -62.37 -23.84 67.03 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.846 0.858 . . . . 54.42 112.842 -175.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.3 t -69.6 -35.62 75.48 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.35 0.66 . . . . 73.5 110.763 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -97.13 77.24 2.7 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 107.755 -1.202 . . . . 75.21 107.755 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.551 ' HA ' HD13 ' A' ' 58' ' ' ILE . 36.8 tt0 -66.34 -15.68 63.46 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.486 -0.779 . . . . 73.02 112.138 -172.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -63.35 -38.02 89.52 Favored 'General case' 0 C--N 1.35 0.623 0 N-CA-C 110.09 -0.337 . . . . 71.55 110.09 173.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.09 -36.43 84.27 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.593 0.757 . . . . 65.41 110.419 177.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.551 HD13 ' HA ' ' A' ' 55' ' ' GLU . 1.9 mp -61.73 -50.1 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 CA-C-N 115.063 -0.972 . . . . 54.24 109.026 173.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -65.87 -24.62 66.9 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.596 0.758 . . . . 64.14 112.016 -176.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 29.1 m170 -72.94 -39.07 66.54 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.795 0.438 . . . . 74.32 110.251 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.5 m -106.93 112.86 26.02 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.499 0.72 . . . . 74.24 111.614 -172.849 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -55.98 -39.09 71.3 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.201 0.6 . . . . 54.24 111.268 177.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.641 HD11 HD12 ' A' ' 105' ' ' LEU . 21.4 tp -61.62 -40.04 93.44 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 123.718 0.637 . . . . 70.12 111.065 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.409 ' HA ' HD11 ' A' ' 77' ' ' LEU . . . -65.94 -42.97 89.33 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.071 0.548 . . . . 64.11 111.003 179.446 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -55.89 -50.69 69.97 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.259 0.624 . . . . 75.44 109.947 176.186 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.494 ' HB3' HD22 ' A' ' 104' ' ' LEU . 26.7 mm-40 -59.31 -50.66 73.15 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.441 1.096 . . . . 73.43 112.613 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.0 mt -66.85 -51.28 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.354 0.662 . . . . 72.14 111.475 -174.109 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -67.18 -29.99 69.83 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.038 0.535 . . . . 74.44 111.827 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -70.07 -59.53 2.84 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-O 120.883 0.373 . . . . 72.23 110.814 176.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -82.75 -10.51 58.86 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.578 0.751 . . . . 72.12 111.984 -170.367 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.485 ' SG ' HG12 ' A' ' 97' ' ' ILE . 44.4 t -145.49 84.08 8.64 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 108.696 -0.853 . . . . 65.45 108.696 169.393 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -69.91 2.64 3.44 Favored 'Trans proline' 0 C--N 1.381 2.278 0 C-N-CA 123.195 2.597 . . . . 53.11 113.817 179.219 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' GLY . . . . . 0.506 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -84.39 -1.44 89.35 Favored Glycine 0 C--N 1.349 1.259 0 N-CA-C 114.168 0.427 . . . . 72.01 114.168 176.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 89.3 t -85.45 132.07 32.74 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 123.211 0.604 . . . . 64.41 109.443 174.389 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -84.01 -50.31 8.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.561 1.144 . . . . 71.0 110.875 176.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.8 p -155.02 155.5 34.27 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.61 -0.723 . . . . 73.12 110.955 -174.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.409 HD11 ' HA ' ' A' ' 64' ' ' ALA . 36.3 mt -106.85 148.58 28.37 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.378 -1.341 . . . . 74.12 107.378 170.556 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.57 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 50.6 ttm -125.32 101.08 6.8 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 106.6 -1.63 . . . . 74.15 106.6 167.287 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.78 HG21 HG11 ' A' ' 115' ' ' VAL . 18.2 mm -81.01 107.44 13.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 107.921 -1.14 . . . . 65.52 107.921 -178.363 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.53 170.38 36.88 Favored Glycine 0 C--O 1.245 0.805 0 N-CA-C 109.689 -1.364 . . . . 61.42 109.689 171.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.544 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 6.9 p-10 -59.64 -51.41 69.94 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 123.854 0.384 . . . . 73.44 110.588 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -107.2 -30.46 8.74 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.01 0.524 . . . . 63.33 111.121 177.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -99.2 161.22 13.74 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.2 0.6 . . . . 75.12 111.876 -172.663 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.486 ' HB2' HD13 ' A' ' 40' ' ' LEU . 26.3 tp -134.24 112.04 10.74 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.747 0.819 . . . . 74.21 108.99 172.341 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.57 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 25.5 m -100.79 105.52 16.83 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.868 -0.79 . . . . 61.34 108.868 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 29' ' ' ALA . 33.4 mm -88.26 124.97 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 108.787 -0.819 . . . . 73.13 108.787 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -110.31 123.77 50.44 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.193 -1.04 . . . . 71.22 108.193 177.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.456 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -117.52 178.33 4.43 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.051 0.54 . . . . 75.45 110.67 -173.199 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.402 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 23.2 t70 -92.33 155.41 17.94 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.536 0.734 . . . . 72.3 110.432 173.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -58.26 -35.43 71.74 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.603 1.161 . . . . 71.22 113.635 -173.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 79.3 mtp -76.69 -21.38 55.45 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.847 0.459 . . . . 71.33 111.85 -175.641 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.506 HG11 ' HA3' ' A' ' 73' ' ' GLY . 10.9 t -103.21 121.08 54.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 108.824 -0.806 . . . . 74.44 108.824 -173.881 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -101.61 150.88 22.64 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.042 0.937 . . . . 75.15 109.271 -171.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.456 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 85.6 m95 -59.52 -15.71 19.77 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.893 1.071 . . . . 75.5 113.893 -172.386 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -58.61 -39.24 79.88 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.698 0.799 . . . . 72.33 111.692 176.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.3 t -91.29 -12.99 33.48 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.666 0.787 . . . . 74.42 111.32 -176.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.485 HG12 ' SG ' ' A' ' 71' ' ' CYS . 59.6 mt -103.27 -54.79 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 C-N-CA 123.769 0.828 . . . . 74.02 111.253 -168.501 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -54.34 -54.19 50.96 Favored Pre-proline 0 CA--C 1.566 1.596 0 C-N-CA 124.78 1.232 . . . . 63.33 113.494 -171.35 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.29 -36.12 80.98 Favored 'Trans proline' 0 C--N 1.401 3.318 0 C-N-CA 122.237 1.958 . . . . 74.15 112.237 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 15.6 mm-40 -62.65 -48.66 78.38 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.579 -0.737 . . . . 72.24 110.085 178.586 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.413 ' O ' HD13 ' A' ' 105' ' ' LEU . 50.9 mt -67.29 -41.79 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 123.395 0.678 . . . . 73.11 111.755 -177.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.521 HG23 ' HB ' ' A' ' 19' ' ' ILE . 57.9 mt -56.82 -41.25 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 123.112 0.565 . . . . 73.12 110.854 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -57.18 -52.13 66.54 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.46 0.704 . . . . 73.45 110.609 174.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.494 HD22 ' HB3' ' A' ' 66' ' ' GLN . 61.8 mt -64.04 -36.13 82.98 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.353 1.061 . . . . 54.21 112.316 -174.572 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.641 HD12 HD11 ' A' ' 63' ' ' LEU . 9.2 mp -69.88 -29.48 66.7 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.642 0.777 . . . . 53.54 111.028 177.814 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 50.3 m -78.14 -41.51 34.72 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.953 -0.758 . . . . 34.42 108.953 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -58.32 -56.86 16.57 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.337 1.055 . . . . 71.14 111.218 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.493 ' OE1' ' HB2' ' A' ' 63' ' ' LEU . 28.9 tt0 -58.04 -50.32 73.83 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.72 0.808 . . . . 71.03 111.585 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.403 ' HB2' HG13 ' A' ' 17' ' ' ILE . 82.4 mt -77.58 -18.07 57.23 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 115.049 -0.978 . . . . 64.12 111.639 -175.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.36 -42.57 71.64 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 122.746 0.419 . . . . 62.44 110.401 173.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -72.9 -19.33 61.29 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.858 -0.61 . . . . 74.32 110.361 172.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.81 59.58 2.77 Favored Glycine 0 C--N 1.344 1.022 0 CA-C-N 115.729 -0.669 . . . . 32.13 112.413 173.328 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -137.12 157.27 47.07 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 123.12 0.568 . . . . 73.2 110.119 177.704 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -80.68 160.46 24.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.803 1.241 . . . . 73.43 110.177 177.447 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.78 HG11 HG21 ' A' ' 79' ' ' ILE . 2.1 p . . . . . 0 N--CA 1.479 0.991 0 C-N-CA 124.521 1.129 . . . . 75.34 112.478 178.304 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.415 ' HB ' HG23 ' A' ' 106' ' ' THR . 72.9 mt . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 120.503 0.192 . . . . 71.41 110.816 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.88 121.93 16.17 Favored 'General case' 0 C--O 1.242 0.666 0 O-C-N 123.902 0.751 . . . . 73.2 109.982 172.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 47.6 mm -127.16 116.59 44.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 105.915 -1.883 . . . . 73.42 105.915 172.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -101.69 151.75 21.66 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.83 -1.174 . . . . 71.04 107.83 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.8 m -122.7 112.61 18.15 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.202 -0.666 . . . . 74.13 109.202 175.127 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.7 mt -86.72 139.46 30.72 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.701 0.8 . . . . 42.54 110.086 176.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -78.77 144.7 34.91 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.525 0.73 . . . . 73.43 109.344 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.9 p -122.98 162.68 37.8 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 124.332 1.053 . . . . 74.23 109.667 -174.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -75.81 43.77 1.16 Allowed 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 123.008 2.472 . . . . 74.33 112.448 171.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -155.79 138.47 15.15 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.763 -0.829 . . . . 70.45 108.763 -176.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -81.39 -43.12 19.44 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.545 0.738 . . . . 63.14 110.876 178.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -67.53 -45.42 75.79 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.894 0.877 . . . . 71.11 110.31 -178.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.55 132.19 35.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.41 0.684 . . . . 54.21 110.907 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 tp -135.49 128.9 32.26 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 108.382 -0.97 . . . . 73.34 108.382 172.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -93.11 118.2 30.94 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.437 0.695 . . . . 63.44 111.5 -171.458 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -103.39 116.69 32.9 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.306 1.042 . . . . 61.31 108.25 172.487 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.7 tp -104.18 127.65 51.81 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.639 0.776 . . . . 71.13 110.088 -178.411 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.4 t -83.69 115.95 22.42 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.749 -0.834 . . . . 71.21 108.749 174.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 71.4 p -107.47 -43.46 4.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 122.825 0.45 . . . . 73.33 112.02 -171.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -102.1 -24.95 13.89 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 112.575 0.583 . . . . 75.33 112.575 -174.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLY . . . . . 0.403 ' HA3' HD13 ' A' ' 109' ' ' LEU . . . -81.75 -140.51 3.18 Favored Glycine 0 C--N 1.34 0.795 0 C-N-CA 121.603 -0.332 . . . . 74.12 112.504 -175.747 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.515 ' HB2' HD22 ' A' ' 109' ' ' LEU . 41.0 mt-10 -99.24 -171.67 2.12 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.398 0.679 . . . . 62.41 109.763 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 13.9 ttt -106.93 143.37 35.13 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.364 -0.976 . . . . 73.04 108.364 177.867 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -75.02 -56.61 4.56 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.561 0.744 . . . . 73.54 111.371 -174.683 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.472 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.7 tp-100 . . . . . 0 N--CA 1.485 1.316 0 C-N-CA 124.378 1.071 . . . . 73.13 109.127 -173.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.7 t . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 109.329 -0.619 . . . . 75.54 109.329 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -77.02 127.87 33.47 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 109.585 -0.524 . . . . 74.34 109.585 174.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.0 p -65.25 119.59 11.18 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.042 0.937 . . . . 72.23 111.502 -179.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.0 mp -79.97 109.7 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.132 0.973 . . . . 70.43 109.028 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 96.4 t -91.94 114.81 29.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 108.664 -0.865 . . . . 53.44 108.664 178.403 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 70.4 mt -110.19 111.2 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 108.373 -0.973 . . . . 55.03 108.373 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -89.15 172.53 9.02 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 120.975 0.417 . . . . 74.15 110.25 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -65.24 -23.35 67.04 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.649 0.78 . . . . 73.32 110.935 170.582 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.2 p -79.45 -25.18 42.02 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.913 0.885 . . . . 60.22 111.145 175.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.409 ' O ' HG13 ' A' ' 58' ' ' ILE . 15.9 m-20 -83.86 55.91 3.46 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.643 0.777 . . . . 54.52 110.264 176.106 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -56.28 -35.79 67.88 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.81 0.844 . . . . 75.13 111.37 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.85 -42.67 84.92 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.123 0.969 . . . . 71.44 110.924 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.9 mt -79.13 -29.38 43.14 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.717 -0.674 . . . . 72.35 111.022 -178.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 54' ' ' ASP . 76.2 mt -63.36 -50.98 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 123.228 0.611 . . . . 62.51 109.557 175.698 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -59.9 -32.14 70.46 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.294 0.638 . . . . 52.13 110.572 176.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -78.34 -15.45 58.7 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 122.725 0.41 . . . . 73.53 111.68 -177.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 56.8 p -124.39 113.86 18.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.71 0.404 . . . . 74.15 110.881 -178.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -53.51 -47.43 69.9 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.138 1.375 . . . . 74.11 112.105 -176.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.46 ' HB2' ' OE1' ' A' ' 108' ' ' GLN . 24.9 tp -62.01 -39.99 94.15 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.143 -0.935 . . . . 73.12 111.97 -176.22 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.36 -45.58 93.0 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.245 0.618 . . . . 35.34 111.406 -177.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -54.69 -46.14 74.06 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.515 1.134 . . . . 72.04 110.863 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.418 ' HB3' HD22 ' A' ' 104' ' ' LEU . 18.3 mm100 -63.52 -45.54 90.15 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.108 0.963 . . . . 61.51 112.137 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.8 mt -65.11 -47.51 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.119 0.568 . . . . 75.41 111.171 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -65.65 -31.84 73.09 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.305 0.642 . . . . 64.41 111.501 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.34 -57.3 7.77 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.287 0.635 . . . . 55.41 111.063 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -72.2 -29.16 63.71 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.836 -0.62 . . . . 74.13 111.546 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.548 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 63.6 m -137.73 88.58 16.09 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 108.938 -0.764 . . . . 71.21 108.938 -179.161 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.79 -3.89 12.95 Favored 'Trans proline' 0 C--N 1.379 2.156 0 C-N-CA 123.052 2.501 . . . . 62.11 113.676 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.71 -15.72 80.96 Favored Glycine 0 C--N 1.352 1.418 0 O-C-N 123.196 0.31 . . . . 63.33 112.851 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.511 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 95.7 t -67.23 122.27 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 123.372 0.669 . . . . 52.22 109.649 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -83.31 -44.93 14.36 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.807 0.843 . . . . 74.11 110.739 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 61.5 p -155.01 170.92 20.65 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.511 0.672 . . . . 63.3 111.22 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 78.8 mt -129.97 156.72 43.98 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.93 1.292 . . . . 62.23 108.661 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.562 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 50.8 ttm -130.09 100.54 5.46 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.303 -1.369 . . . . 70.33 107.303 170.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.479 HD12 HG21 ' A' ' 115' ' ' VAL . 40.7 mm -74.67 107.73 5.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 107.547 -1.279 . . . . 73.45 107.547 176.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.66 -117.09 0.28 Allowed Glycine 0 C--N 1.34 0.777 0 N-CA-C 110.063 -1.215 . . . . 64.03 110.063 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.472 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 1.6 p-10 -149.32 -57.68 0.2 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.093 0.557 . . . . 75.04 109.657 171.174 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -83.69 -29.58 27.46 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.864 0.466 . . . . 65.43 109.791 170.89 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -116.47 170.3 8.67 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.982 0.913 . . . . 73.31 110.814 -174.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 46.0 tp -135.12 146.05 48.45 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.313 1.445 . . . . 72.23 107.471 171.456 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.562 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 35.5 m -127.71 130.18 48.4 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 109.132 -0.692 . . . . 73.34 109.132 175.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.1 mm -108.16 128.51 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 108.894 -0.78 . . . . 75.51 108.894 -178.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -109.11 107.2 17.42 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 108.882 -0.784 . . . . 73.12 108.882 178.324 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -106.6 163.59 12.76 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.216 0.606 . . . . 75.12 109.716 -178.821 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.65 145.23 38.95 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 122.635 0.374 . . . . 72.44 110.282 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -58.89 -34.94 72.22 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.181 0.992 . . . . 74.15 112.869 -173.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.8 mmm -70.85 -26.02 63.08 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.124 0.57 . . . . 73.23 110.559 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.5 t -91.77 142.3 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.044 -1.095 . . . . 65.52 108.044 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -109.03 146.2 34.32 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.944 0.498 . . . . 73.13 111.116 -174.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' TRP . . . . . 0.494 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 80.4 m95 -63.14 -13.54 38.0 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.054 0.941 . . . . 63.21 112.809 178.816 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -52.56 -39.71 61.78 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.173 0.989 . . . . 74.22 112.079 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 40.5 m -103.42 -0.53 29.88 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.366 0.667 . . . . 52.45 112.211 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.548 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 57.2 mt -109.49 -50.83 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 123.322 0.649 . . . . 61.15 111.275 -171.586 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.0 ttpm? -55.94 -51.74 78.08 Favored Pre-proline 0 CA--C 1.561 1.398 0 CA-C-O 117.778 -1.106 . . . . 74.51 113.28 -170.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.02 -33.65 91.74 Favored 'Trans proline' 0 C--N 1.4 3.266 0 C-N-CA 121.799 1.666 . . . . 34.43 112.157 -177.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 8.0 mm-40 -65.36 -47.51 76.17 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 115.513 -0.767 . . . . 75.41 110.24 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.1 mt -70.64 -37.97 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.042 0.537 . . . . 74.3 111.497 -177.835 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 97.9 mt -54.79 -44.37 71.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 N-CA-C 109.732 -0.47 . . . . 45.54 109.732 173.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 32.5 t70 -67.19 -40.74 86.55 Favored 'General case' 0 C--N 1.351 0.671 0 CA-C-N 115.039 -0.982 . . . . 72.42 111.181 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 95.9 mt -61.86 -39.96 93.68 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.803 0.841 . . . . 74.31 111.96 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.451 HD12 HD11 ' A' ' 63' ' ' LEU . 10.9 mp -71.06 -21.26 62.27 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.597 -0.729 . . . . 74.53 110.628 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.415 HG23 ' HB ' ' A' ' 17' ' ' ILE . 24.0 m -81.73 -37.88 26.6 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.985 -0.746 . . . . 74.11 108.985 174.742 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 103' ' ' ASP . 11.0 mmpt? -59.33 -62.57 1.78 Allowed 'General case' 0 C--N 1.368 1.388 0 C-N-CA 124.041 0.936 . . . . 73.4 110.924 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.46 ' OE1' ' HB2' ' A' ' 63' ' ' LEU . 25.9 tt0 -55.41 -47.13 76.39 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 124.658 1.224 . . . . 71.31 111.652 -171.72 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 38' ' ' GLU . 82.7 mt -70.83 -30.62 67.09 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 115.459 -0.791 . . . . 73.35 111.128 -178.149 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.39 -26.91 61.19 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.016 0.526 . . . . 73.05 111.348 176.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -72.77 -27.05 61.78 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.762 0.425 . . . . 71.33 110.148 170.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 91.59 36.02 6.67 Favored Glycine 0 C--N 1.346 1.117 0 N-CA-C 111.543 -0.623 . . . . 60.14 111.543 -177.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -120.54 159.57 24.94 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.155 0.982 . . . . 72.42 111.203 -173.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.9 174.02 6.06 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.338 1.055 . . . . 70.1 109.093 172.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.479 HG21 HD12 ' A' ' 79' ' ' ILE . 1.9 p . . . . . 0 CA--C 1.55 0.974 0 N-CA-C 112.909 0.707 . . . . 72.22 112.909 -171.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.451 HG21 HD12 ' A' ' 109' ' ' LEU . 59.2 mt . . . . . 0 C--O 1.237 0.407 0 N-CA-C 110.313 -0.255 . . . . 74.43 110.313 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -62.86 99.73 0.17 Allowed 'General case' 0 CA--C 1.548 0.884 0 O-C-N 124.032 0.833 . . . . 71.44 111.042 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.0 mm -119.66 107.0 20.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 106.044 -1.836 . . . . 70.34 106.044 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -99.36 127.57 45.4 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.392 -0.595 . . . . 71.21 109.392 -172.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.5 t -91.08 126.55 36.2 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-O 121.527 0.68 . . . . 63.23 109.635 -176.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.474 HD11 HD22 ' A' ' 33' ' ' LEU . 84.3 mt -123.58 138.08 54.62 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 124.566 1.146 . . . . 71.11 108.834 -176.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 62.3 p -74.73 147.95 40.9 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.539 -0.755 . . . . 74.14 110.621 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.7 p -117.31 162.97 25.49 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 123.977 0.911 . . . . 72.51 109.922 -176.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.83 -13.19 37.99 Favored 'Trans proline' 0 C--N 1.383 2.347 0 C-N-CA 122.6 2.2 . . . . 64.32 113.094 172.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -98.88 131.51 44.91 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.438 0.695 . . . . 74.43 109.208 175.393 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.8 -30.94 70.48 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.142 0.577 . . . . 65.32 111.164 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 26.8 p-10 -95.23 2.32 54.87 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.521 0.728 . . . . 74.14 112.401 -174.443 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -111.27 156.58 21.27 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.035 0.534 . . . . 60.02 110.188 174.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.7 tp -149.38 120.19 7.59 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 108.813 -0.81 . . . . 64.13 108.813 175.123 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -82.43 117.94 22.84 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.849 0.86 . . . . 71.12 110.194 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -100.26 119.34 38.24 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 107.73 -1.211 . . . . 74.01 107.73 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.474 HD22 HD11 ' A' ' 22' ' ' LEU . 27.3 tp -102.2 125.59 48.94 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.706 -0.85 . . . . 72.51 108.706 -172.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.5 m -85.61 105.87 16.5 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.206 -1.405 . . . . 61.25 107.206 175.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.9 p -94.05 101.11 13.13 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.533 0.733 . . . . 72.12 109.314 -178.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.4 t70 62.26 74.87 0.42 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.758 1.223 . . . . 72.31 111.033 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -151.85 -127.94 1.37 Allowed Glycine 0 C--N 1.342 0.865 0 CA-C-N 115.033 -0.985 . . . . 64.4 111.64 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.535 ' HB2' HD22 ' A' ' 109' ' ' LEU . 56.6 mm-40 -98.06 151.73 20.04 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 117.718 0.759 . . . . 73.14 111.269 178.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 12.0 tpt -88.04 99.75 12.41 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.146 -0.934 . . . . 75.51 108.902 177.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.04 -51.18 63.03 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.685 0.794 . . . . 44.14 111.986 -170.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.485 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.7 tp-100 . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 108.819 -0.808 . . . . 74.22 108.819 173.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.6 t . . . . . 0 CA--C 1.541 0.632 0 N-CA-C 107.984 -1.117 . . . . 62.32 107.984 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -61.2 146.22 48.46 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.398 0.679 . . . . 62.32 111.559 -178.087 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.5 p -69.68 97.74 1.1 Allowed 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 109.102 -0.703 . . . . 61.05 109.102 173.221 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 72.8 mt -72.44 109.49 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 115.709 -0.678 . . . . 61.42 110.366 -170.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.5 t -85.4 106.59 15.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 107.906 -1.146 . . . . 64.45 107.906 176.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.473 HG12 ' HB3' ' A' ' 57' ' ' LEU . 59.1 mt -96.33 109.65 23.24 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.349 0 N-CA-C 107.498 -1.297 . . . . 75.12 107.498 -177.054 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -92.4 160.18 15.22 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 117.737 0.244 . . . . 73.43 110.385 -178.311 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -66.76 -21.59 66.05 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.817 0.447 . . . . 64.31 111.382 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 10.0 t -93.06 -23.78 18.53 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.861 0.864 . . . . 51.12 110.536 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.14 69.82 10.52 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.235 -0.654 . . . . 63.14 109.235 174.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -64.2 -24.61 67.74 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.982 -1.008 . . . . 72.35 110.831 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -59.74 -36.83 77.4 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.95 0.9 . . . . 71.11 110.835 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.473 ' HB3' HG12 ' A' ' 50' ' ' ILE . 88.1 mt -82.9 -28.68 29.81 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.567 0.747 . . . . 62.13 111.517 176.026 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.472 HG22 ' HG2' ' A' ' 65' ' ' GLN . 61.7 mt -65.09 -40.14 87.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.45 0.7 . . . . 52.4 110.114 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -65.97 -17.11 64.46 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.113 0.565 . . . . 63.51 112.096 175.37 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -85.79 6.57 27.42 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.169 0.588 . . . . 61.43 112.31 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.2 t -159.74 114.83 2.38 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.247 0.619 . . . . 75.43 110.512 179.167 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 3.9 tppp? -63.16 -32.7 74.16 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.703 0.401 . . . . 72.45 110.844 173.641 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.451 HD11 ' HB3' ' A' ' 104' ' ' LEU . 44.8 tp -63.73 -41.18 98.09 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 122.783 0.433 . . . . 71.43 110.367 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.61 -44.57 96.16 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 123.16 0.584 . . . . 73.21 110.324 177.604 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.472 ' HG2' HG22 ' A' ' 58' ' ' ILE . 76.2 mt-30 -55.5 -42.93 75.12 Favored 'General case' 0 C--N 1.351 0.66 0 O-C-N 124.497 1.123 . . . . 72.44 110.973 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 14.6 mm100 -69.73 -38.29 76.81 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.124 0.569 . . . . 73.25 112.427 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ILE . . . . . 0.453 HG22 HG21 ' A' ' 74' ' ' VAL . 81.8 mt -68.32 -48.16 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 122.716 0.406 . . . . 61.41 110.473 -178.428 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -65.19 -32.3 73.91 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.754 -0.657 . . . . 70.25 111.391 177.409 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.5 tp -67.66 -56.38 9.58 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.236 0.614 . . . . 71.51 110.692 177.662 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -59.41 -34.04 71.96 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.738 0.815 . . . . 43.42 112.015 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.528 ' SG ' HG23 ' A' ' 97' ' ' ILE . 63.8 m -137.05 114.89 10.02 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 110.183 -0.303 . . . . 52.44 110.183 -176.189 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -71.72 -11.04 27.45 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.327 2.018 . . . . 70.43 111.849 171.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -88.04 18.65 39.01 Favored Glycine 0 C--N 1.355 1.601 0 CA-C-O 119.79 -0.45 . . . . 74.32 113.277 -177.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.631 HG22 ' NZ ' ' A' ' 88' ' ' LYS . 15.1 t -97.54 124.79 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 108.794 -0.817 . . . . 75.43 108.794 172.26 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -84.2 -52.21 6.43 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.656 0.382 . . . . 61.41 110.297 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 97.1 p -156.18 172.31 18.67 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 112.057 0.391 . . . . 62.41 112.057 -177.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 34.5 mt -131.47 126.03 33.98 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 108.226 -1.027 . . . . 74.3 108.226 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.486 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.3 ttm -100.92 111.56 23.8 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.775 -0.824 . . . . 73.43 108.775 178.716 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.616 HD13 HD13 ' A' ' 84' ' ' LEU . 20.9 mm -86.16 98.05 6.48 Favored 'Isoleucine or valine' 0 C--N 1.349 0.564 0 N-CA-C 108.82 -0.807 . . . . 71.34 108.82 -177.884 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.06 176.27 42.15 Favored Glycine 0 C--O 1.243 0.715 0 N-CA-C 111.174 -0.77 . . . . 50.4 111.174 176.019 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.485 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 31.1 m-20 -51.48 -59.74 3.92 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.265 1.026 . . . . 74.1 111.611 -176.216 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -128.5 22.46 5.97 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.153 -1.385 . . . . 74.44 110.016 -174.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PHE . . . . . 0.441 ' HB3' HD12 ' A' ' 33' ' ' LEU . 37.0 p90 -149.12 154.94 39.95 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 122.895 0.478 . . . . 74.54 110.789 -175.162 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.616 HD13 HD13 ' A' ' 79' ' ' ILE . 27.5 tp -131.34 110.95 11.44 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 108.082 -1.081 . . . . 70.13 108.082 176.922 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 41.7 m -100.01 109.73 22.05 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 108.48 -0.934 . . . . 51.42 108.48 -176.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.547 HG13 HD13 ' A' ' 101' ' ' ILE . 20.9 mm -86.38 131.71 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 N-CA-C 108.012 -1.107 . . . . 72.02 108.012 -175.362 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -112.0 124.44 52.4 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.017 -1.105 . . . . 71.22 108.017 178.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.631 ' NZ ' HG22 ' A' ' 74' ' ' VAL . 69.1 mttm -129.12 177.39 7.18 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.318 1.047 . . . . 73.55 109.475 -178.307 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.11 139.37 58.76 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.49 0.494 . . . . 72.3 109.956 168.597 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -62.1 -27.52 68.98 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.661 0.784 . . . . 61.42 112.571 -174.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 26.4 mmt -87.38 -16.72 34.14 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.584 0.354 . . . . 74.01 111.659 -178.111 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 72.6 t -75.57 133.76 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.395 -0.965 . . . . 63.05 108.395 173.049 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 65.5 m170 -104.53 148.88 25.99 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.25 0.548 . . . . 72.14 110.33 -176.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -76.94 -19.13 57.74 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.134 0.974 . . . . 75.24 112.262 -173.278 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -57.7 -26.95 62.45 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.901 0.48 . . . . 74.55 111.667 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -82.81 -52.49 6.69 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 122.961 0.505 . . . . 75.44 111.989 177.215 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.528 HG23 ' SG ' ' A' ' 71' ' ' CYS . 26.8 mt -93.94 -33.46 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 113.133 0.79 . . . . 55.41 113.133 -164.386 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -49.43 -46.74 78.16 Favored Pre-proline 0 CA--C 1.568 1.667 0 CA-C-O 117.564 -1.207 . . . . 70.02 113.784 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -56.0 -35.59 94.76 Favored 'Trans proline' 0 C--N 1.396 3.029 0 CA-C-N 121.626 1.616 . . . . 60.42 112.844 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -73.16 -34.83 66.27 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.207 0.603 . . . . 51.51 110.595 -179.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.547 HD13 HG13 ' A' ' 86' ' ' ILE . 84.0 mt -68.5 -49.06 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.481 0.712 . . . . 75.32 109.921 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 87.1 mt -58.23 -38.07 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.594 0.758 . . . . 74.2 110.301 177.306 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ASP . . . . . 0.401 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 13.6 t70 -61.98 -51.53 67.69 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.829 0.852 . . . . 73.42 110.923 176.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.451 ' HB3' HD11 ' A' ' 63' ' ' LEU . 69.7 mt -62.9 -39.38 94.33 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.09 0.956 . . . . 55.23 111.92 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.491 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 8.5 mp -70.42 -28.55 65.14 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.398 0.679 . . . . 62.43 110.5 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 94.8 m -69.58 -37.06 76.82 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 109.111 -0.699 . . . . 74.11 109.111 174.743 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' A' ' 103' ' ' ASP . 45.3 mmtm -67.9 -44.95 75.76 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.053 0.541 . . . . 72.13 110.328 178.61 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -58.23 -47.23 84.18 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.447 1.099 . . . . 75.55 111.017 -178.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 38' ' ' GLU . 18.0 mt -76.4 -26.55 55.7 Favored 'General case' 0 CA--C 1.553 1.08 0 CA-C-N 115.821 -0.627 . . . . 73.3 110.708 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.26 -21.88 60.52 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.042 0.537 . . . . 74.11 111.69 178.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -69.4 -24.81 63.9 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 110.133 -0.321 . . . . 44.33 110.133 170.357 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 71.76 38.52 60.82 Favored Glycine 0 C--N 1.347 1.161 0 N-CA-C 111.079 -0.808 . . . . 63.12 111.079 -174.395 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -135.59 160.4 38.62 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 124.11 0.964 . . . . 71.31 111.643 -173.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -78.93 152.59 31.01 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 114.404 -1.271 . . . . 63.24 109.293 177.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.484 1.253 0 C-N-CA 122.839 0.456 . . . . 73.54 110.535 178.489 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 64.5 mt . . . . . 0 N--CA 1.469 0.498 0 N-CA-C 109.304 -0.628 . . . . 71.23 109.304 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -71.89 136.18 46.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.521 -0.763 . . . . 74.51 109.229 -176.747 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 48.9 mm -118.55 143.32 29.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 N-CA-C 107.9 -1.148 . . . . 64.33 107.9 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HD2' HD23 ' A' ' 33' ' ' LEU . 40.4 ttmt -91.49 114.97 27.64 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.421 -0.585 . . . . 64.22 109.421 -177.516 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 97.6 m -95.05 120.88 36.01 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 108.93 -0.767 . . . . 74.54 108.93 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.6 mt -125.23 141.91 51.81 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.333 1.053 . . . . 72.43 109.536 -174.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.6 p -73.97 143.37 45.67 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.143 0.577 . . . . 72.24 110.44 174.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.3 p -111.95 160.89 28.19 Favored Pre-proline 0 N--CA 1.478 0.947 0 C-N-CA 124.245 1.018 . . . . 72.21 109.401 -178.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -79.29 30.85 0.47 Allowed 'Trans proline' 0 C--N 1.375 1.95 0 C-N-CA 123.192 2.595 . . . . 71.14 112.855 172.208 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -142.28 127.43 18.57 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.398 -0.964 . . . . 64.44 108.398 -177.185 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -73.2 158.22 35.66 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.382 -0.599 . . . . 63.12 109.382 173.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 70.49 -6.46 1.19 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.113 1.365 . . . . 72.32 111.68 -173.44 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.42 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -117.57 145.51 44.23 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 124.101 0.961 . . . . 63.5 109.758 -172.598 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.6 tp -153.2 129.69 10.67 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 108.864 -0.791 . . . . 75.54 108.864 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -82.82 131.53 35.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.754 0.821 . . . . 63.5 111.127 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -122.19 114.37 20.76 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.977 -1.49 . . . . 73.21 106.977 172.68 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.46 HD23 ' HD2' ' A' ' 20' ' ' LYS . 52.7 tp -113.86 127.92 56.19 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 123.983 0.913 . . . . 61.22 110.269 -165.782 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 m -90.29 103.73 16.38 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.156 -1.053 . . . . 63.32 108.156 177.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 73.5 p -102.34 -11.45 18.66 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.966 0.907 . . . . 64.12 111.578 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -62.88 -44.93 94.79 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.943 0.897 . . . . 73.43 111.875 -177.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 150.83 -32.4 0.98 Allowed Glycine 0 C--N 1.346 1.108 0 CA-C-N 116.277 -0.42 . . . . 53.32 113.184 178.852 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -69.98 106.66 3.28 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.036 0.446 . . . . 51.03 109.829 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.5 tpt -85.2 133.97 34.17 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.319 1.048 . . . . 62.42 109.865 -171.606 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.415 ' O ' HG12 ' A' ' 115' ' ' VAL . 73.5 mt -70.46 -35.59 73.41 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.473 0.709 . . . . 73.41 112.756 -172.402 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 . . . . . 0 N--CA 1.48 1.063 0 N-CA-C 107.874 -1.158 . . . . 72.2 107.874 172.317 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.57 ' HB3' ' HB3' ' A' ' 81' ' ' ASP . 35.1 t . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 121.117 0.484 . . . . 73.11 110.908 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -81.22 154.28 26.73 Favored 'General case' 0 C--O 1.246 0.892 0 C-N-CA 123.932 0.893 . . . . 72.44 110.116 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.0 p -79.39 91.47 5.09 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.902 0.481 . . . . 72.23 109.825 176.345 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.3 mt -75.77 116.69 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.018 0.927 . . . . 75.31 109.866 -176.904 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.5 t -90.88 119.28 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 108.579 -0.897 . . . . 72.34 108.579 178.566 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.411 HG23 ' HB2' ' A' ' 57' ' ' LEU . 61.3 mt -117.11 110.65 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 107.775 -1.194 . . . . 70.15 107.775 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.402 ' HG2' ' HB2' ' A' ' 76' ' ' SER . 10.2 mtmp? -93.29 172.58 8.2 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 109.595 -0.52 . . . . 74.15 109.595 177.643 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.9 p30 -64.7 -21.15 66.68 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.212 0.605 . . . . 70.15 112.345 -177.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.5 t -83.92 -21.18 31.95 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 122.507 0.323 . . . . 74.23 110.717 176.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -83.23 56.33 3.49 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.999 0.92 . . . . 73.42 110.296 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.425 ' HA ' HD12 ' A' ' 58' ' ' ILE . 34.5 tt0 -63.73 -25.72 68.32 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.457 0.703 . . . . 63.22 111.667 -175.096 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.18 -45.51 93.08 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.79 0.836 . . . . 72.32 110.281 173.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.411 ' HB2' HG23 ' A' ' 50' ' ' ILE . 87.0 mt -73.29 -30.03 63.13 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 115.703 -0.681 . . . . 71.22 111.106 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 55' ' ' GLU . 75.5 mt -65.28 -39.06 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.203 0.601 . . . . 73.03 109.427 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -70.68 -10.85 60.34 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 112.965 0.728 . . . . 73.04 112.965 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -80.79 -34.3 34.19 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.701 0.4 . . . . 54.0 110.619 170.561 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.3 t -108.65 106.78 16.98 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.326 0.65 . . . . 61.43 110.611 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -54.77 -37.51 66.09 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.392 0.677 . . . . 72.15 110.809 173.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.13 -42.55 99.52 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.537 0.735 . . . . 73.55 111.033 178.376 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.79 -45.08 93.41 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 122.819 0.448 . . . . 72.41 109.833 178.638 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -55.95 -44.38 78.37 Favored 'General case' 0 C--N 1.353 0.734 0 O-C-N 124.065 0.853 . . . . 74.13 110.812 177.382 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -62.36 -46.56 88.09 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.69 0.796 . . . . 73.3 112.069 178.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.9 mt -64.71 -49.83 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 C-N-CA 123.641 0.776 . . . . 61.44 111.065 -175.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -66.76 -36.19 81.85 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.417 0.687 . . . . 64.43 111.502 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.9 tp -64.99 -46.6 80.76 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.444 0.698 . . . . 73.33 110.835 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.493 ' NE2' HD21 ' A' ' 104' ' ' LEU . 75.3 mt-30 -73.21 -28.92 62.45 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.123 -0.944 . . . . 63.3 111.642 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.439 ' SG ' HD13 ' A' ' 97' ' ' ILE . 42.9 t -149.08 104.16 3.36 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 122.47 0.308 . . . . 64.12 110.783 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -78.08 14.55 1.51 Allowed 'Trans proline' 0 C--N 1.373 1.816 0 C-N-CA 122.738 2.292 . . . . 43.45 112.745 171.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -85.77 -18.42 59.9 Favored Glycine 0 C--N 1.35 1.322 0 N-CA-C 111.764 -0.535 . . . . 75.03 111.764 170.184 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.424 ' HA ' ' HB3' ' A' ' 88' ' ' LYS . 87.7 t -70.74 114.59 8.89 Favored 'Isoleucine or valine' 0 C--N 1.351 0.669 0 N-CA-C 109.228 -0.656 . . . . 70.24 109.228 175.402 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -86.02 -32.95 21.19 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.264 0.626 . . . . 72.51 110.678 -174.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' SER . . . . . 0.402 ' HB2' ' HG2' ' A' ' 51' ' ' LYS . 33.4 t -161.45 167.14 26.13 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 121.345 0.593 . . . . 54.0 111.319 -175.026 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 76.7 mt -134.4 128.61 33.92 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.721 1.208 . . . . 71.0 107.928 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.48 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 54.1 ttm -96.21 108.18 20.61 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 107.371 -1.344 . . . . 71.12 107.371 168.088 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 20.1 mm -91.33 105.38 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.437 0.695 . . . . 71.4 109.146 -174.562 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.87 163.29 24.5 Favored Glycine 0 C--O 1.242 0.636 0 N-CA-C 109.657 -1.377 . . . . 61.52 109.657 173.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ASP . . . . . 0.57 ' HB3' ' HB3' ' A' ' 45' ' ' SER . 19.3 p-10 -74.08 -34.92 64.18 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 122.885 0.474 . . . . 71.32 110.595 175.746 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -99.55 -32.86 10.89 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.933 0.893 . . . . 73.04 111.259 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -131.28 169.28 16.19 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.276 0.63 . . . . 73.55 111.739 -170.333 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 54.2 tp -141.12 109.94 6.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.625 0.77 . . . . 63.35 109.619 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.48 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 59.8 m -100.79 111.57 23.82 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.713 -0.847 . . . . 41.04 108.713 -178.403 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.532 HG13 HD13 ' A' ' 101' ' ' ILE . 27.2 mm -86.99 126.22 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.487 -0.931 . . . . 55.45 108.487 -176.753 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.52 124.63 50.75 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.355 -0.98 . . . . 55.22 108.355 176.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 74' ' ' VAL . 0.6 OUTLIER -150.2 152.96 35.45 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.228 1.011 . . . . 71.44 109.154 -177.042 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -60.57 132.32 53.54 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.203 0.601 . . . . 65.22 110.427 -172.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -62.39 -23.4 66.81 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.633 1.173 . . . . 74.12 112.493 -175.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.2 mmt -66.21 -30.86 71.39 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.865 0.466 . . . . 75.45 110.679 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.6 t -92.98 142.83 12.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 N-CA-C 107.151 -1.426 . . . . 64.13 107.151 172.433 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -102.72 156.82 17.38 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.34 0.59 . . . . 64.31 111.579 -176.204 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -69.02 -17.84 63.96 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 114.629 -1.169 . . . . 54.14 111.795 179.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -56.01 -31.08 62.75 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.756 0.822 . . . . 74.43 111.806 -177.681 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.9 m -92.08 -36.17 13.5 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.382 0.673 . . . . 64.11 112.034 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.439 HD13 ' SG ' ' A' ' 71' ' ' CYS . 30.4 mt -97.74 -43.15 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 N-CA-C 112.305 0.483 . . . . 71.3 112.305 -164.796 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -51.78 -46.15 91.86 Favored Pre-proline 0 N--CA 1.492 1.634 0 CA-C-O 117.76 -1.114 . . . . 73.4 113.68 -177.022 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -53.83 -41.88 70.98 Favored 'Trans proline' 0 C--N 1.402 3.361 0 C-N-CA 121.839 1.693 . . . . 73.14 112.337 173.02 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -67.66 -39.48 84.56 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.345 -0.843 . . . . 70.35 110.486 -178.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.532 HD13 HG13 ' A' ' 86' ' ' ILE . 93.7 mt -62.89 -51.54 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.572 0.749 . . . . 72.45 110.395 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 83.7 mt -59.8 -38.28 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 O-C-N 123.748 0.655 . . . . 65.01 110.682 -178.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -67.94 -39.31 83.46 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.018 0.927 . . . . 61.03 111.278 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.493 HD21 ' NE2' ' A' ' 70' ' ' GLN . 77.7 mt -65.72 -39.99 91.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.565 0.746 . . . . 73.11 111.799 174.058 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 10.8 mp -68.99 -25.0 64.3 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.032 0.533 . . . . 75.02 110.36 176.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 88.6 m -71.61 -50.91 26.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 122.984 0.514 . . . . 73.31 110.038 176.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -65.67 -36.47 83.75 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 123.386 0.429 . . . . 73.52 110.879 -176.165 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -59.41 -56.33 23.37 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 122.72 0.408 . . . . 55.33 110.62 177.613 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 105' ' ' LEU . 50.2 mt -69.65 -22.47 63.45 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 123.792 0.683 . . . . 74.42 111.333 -176.653 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.67 -35.84 70.43 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.567 0.747 . . . . 72.23 111.888 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -108.26 -13.47 14.89 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 122.952 0.501 . . . . 74.11 111.474 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -148.7 -159.12 8.35 Favored Glycine 0 C--N 1.345 1.063 0 N-CA-C 112.082 -0.407 . . . . 62.22 112.082 -175.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -131.85 -60.17 0.93 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.754 0.822 . . . . 72.11 109.106 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -79.87 171.38 15.19 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.31 -1.314 . . . . 51.2 111.98 -174.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.415 HG12 ' O ' ' A' ' 40' ' ' LEU . 5.4 p . . . . . 0 CA--C 1.541 0.634 0 CA-C-N 114.085 -1.416 . . . . 74.31 109.874 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.458 ' HB ' ' HA ' ' A' ' 106' ' ' THR . 69.0 mt . . . . . 0 N--CA 1.467 0.415 0 CA-C-O 120.934 0.397 . . . . 71.24 110.78 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -83.1 131.13 35.16 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 124.568 1.147 . . . . 75.5 110.47 -175.329 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ILE . . . . . 0.403 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.9 mm -130.17 121.32 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 N-CA-C 108.059 -1.089 . . . . 74.22 108.059 -175.313 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -90.77 143.34 26.83 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.732 1.213 . . . . 75.23 110.021 -179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 47.1 m -101.83 120.28 40.12 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 123.43 0.692 . . . . 73.11 109.727 175.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.8 mt -125.16 138.17 54.15 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.133 0.973 . . . . 72.33 109.633 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.5 p -86.66 144.46 27.13 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.06 0.544 . . . . 74.21 110.615 178.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.4 p -108.34 172.78 3.44 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 124.875 1.27 . . . . 75.24 108.469 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -75.57 50.56 2.72 Favored 'Trans proline' 0 C--N 1.376 2.001 0 C-N-CA 122.13 1.887 . . . . 74.22 112.372 168.688 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -162.27 141.14 9.21 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.344 1.058 . . . . 73.54 108.504 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.29 -31.94 13.86 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.137 0.575 . . . . 62.44 110.593 -177.899 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -89.78 7.49 36.65 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.916 0.886 . . . . 74.15 111.798 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.466 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -136.53 126.17 25.4 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.796 0.838 . . . . 63.22 109.052 174.207 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.1 tp -128.42 134.24 48.74 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.461 0.704 . . . . 63.51 109.177 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -90.87 129.74 36.89 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.479 1.111 . . . . 54.33 110.538 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -114.7 116.41 28.65 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.717 -1.216 . . . . 75.34 107.717 171.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.4 tp -100.06 127.32 46.31 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.451 -1.314 . . . . 75.02 107.451 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.2 t -72.39 107.33 4.91 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 107.254 -1.388 . . . . 73.25 107.254 171.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t -105.64 18.97 21.33 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.474 0.654 . . . . 75.02 109.73 -179.26 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -91.32 -55.5 3.49 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.368 0.667 . . . . 64.34 109.888 177.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 156.65 -17.13 0.41 Allowed Glycine 0 C--N 1.344 1.024 0 CA-C-N 115.908 -0.587 . . . . 31.53 113.171 -175.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -84.92 105.76 15.93 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.24 0.616 . . . . 62.11 111.229 -176.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 40.2 ttm -74.97 132.91 41.73 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.502 -0.555 . . . . 75.11 109.502 175.212 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.3 mt -62.64 -48.72 78.12 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.826 0.704 . . . . 73.05 111.342 -177.239 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 . . . . . 0 CA--C 1.54 0.575 0 CA-C-N 116.182 -0.463 . . . . 73.44 109.843 -179.662 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m . . . . . 0 N--CA 1.472 0.642 0 CA-C-O 121.018 0.437 . . . . 71.05 110.79 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -97.3 126.6 42.63 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.755 -1.202 . . . . 73.02 107.755 170.405 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.8 m -59.56 121.53 11.8 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.853 0.861 . . . . 75.51 112.995 -169.489 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 61.4 mt -87.34 130.89 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.011 0.925 . . . . 72.51 110.085 -178.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.5 t -97.46 108.64 21.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 N-CA-C 109.263 -0.643 . . . . 75.35 109.263 178.646 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 72.1 mt -90.38 110.04 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.549 1.14 . . . . 75.33 107.961 175.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -84.24 144.36 28.98 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.544 0.738 . . . . 72.43 110.205 -174.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.4 ' HA ' HD11 ' A' ' 58' ' ' ILE . 31.8 p-10 -65.79 -29.27 69.73 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.086 0.554 . . . . 72.15 111.321 175.482 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 t -82.15 -14.38 55.76 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.818 0.847 . . . . 64.14 111.208 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -102.61 82.46 2.15 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.232 -1.025 . . . . 74.14 108.232 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLU . . . . . 0.415 ' HA ' HD12 ' A' ' 58' ' ' ILE . 0.1 OUTLIER -57.5 -25.05 59.21 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.117 0.967 . . . . 75.04 112.519 -178.298 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -65.39 -52.68 51.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.201 0.601 . . . . 74.34 110.992 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.45 -36.18 77.61 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.951 0.5 . . . . 73.03 110.39 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.415 HD12 ' HA ' ' A' ' 55' ' ' GLU . 68.8 mt -64.46 -47.12 90.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 115.023 -0.99 . . . . 72.22 110.522 177.904 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -62.12 -32.19 72.73 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.334 0.654 . . . . 75.34 112.42 -178.974 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -80.08 -6.47 57.73 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.018 0.527 . . . . 75.31 112.047 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.4 p -131.65 104.46 6.94 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.426 0.691 . . . . 52.32 109.558 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -52.21 -38.28 57.47 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.146 0.978 . . . . 72.34 112.285 -178.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.5 HD11 HD12 ' A' ' 105' ' ' LEU . 22.7 tp -61.89 -42.29 98.9 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 123.975 0.797 . . . . 73.2 111.769 179.098 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.47 -44.12 95.37 Favored 'General case' 0 C--N 1.351 0.669 0 O-C-N 123.66 0.6 . . . . 74.32 110.804 -177.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -54.86 -48.04 73.43 Favored 'General case' 0 C--N 1.348 0.525 0 O-C-N 124.122 0.889 . . . . 74.54 110.643 176.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -63.48 -44.62 93.87 Favored 'General case' 0 CA--C 1.552 1.028 0 O-C-N 123.87 0.731 . . . . 71.32 112.84 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -65.77 -49.68 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 123.328 0.651 . . . . 53.53 110.868 -176.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -69.93 -30.0 67.29 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.656 0.382 . . . . 74.44 111.809 -178.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 67.1 tp -64.11 -48.72 75.01 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.59 0.756 . . . . 72.41 110.693 175.771 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -86.78 -16.88 34.93 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.068 -0.969 . . . . 71.22 111.943 -173.512 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 54.0 t -149.44 104.62 3.29 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 122.928 0.491 . . . . 73.12 110.383 177.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -78.94 5.72 5.49 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.671 2.247 . . . . 63.41 112.765 172.078 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.23 -26.68 67.76 Favored Glycine 0 C--N 1.354 1.539 0 N-CA-C 112.262 -0.335 . . . . 44.21 112.262 176.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 40.7 t -75.36 127.73 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.056 0.542 . . . . 60.33 110.368 -176.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -89.06 -36.43 15.78 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.282 1.033 . . . . 53.2 111.026 -177.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.1 p -164.63 162.02 21.24 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 121.339 0.59 . . . . 62.51 111.633 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.9 mt -118.72 131.14 56.13 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.609 1.163 . . . . 62.54 108.168 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.514 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 43.0 ttm -105.21 103.85 13.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.407 -0.96 . . . . 54.33 108.407 175.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.478 HD13 HD13 ' A' ' 84' ' ' LEU . 49.3 mm -82.38 106.92 13.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 124.447 1.099 . . . . 75.13 108.773 -177.024 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.54 -163.9 39.55 Favored Glycine 0 C--O 1.246 0.863 0 O-C-N 123.688 0.617 . . . . 74.24 111.876 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -64.24 -66.16 0.58 Allowed 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.61 0.719 . . . . 65.34 110.036 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -127.89 10.57 6.51 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 114.055 -1.43 . . . . 71.23 109.603 -175.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -132.52 153.59 50.79 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.987 0.915 . . . . 73.55 110.344 -174.88 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.478 HD13 HD13 ' A' ' 79' ' ' ILE . 46.0 tp -131.64 117.96 19.39 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.221 1.008 . . . . 63.03 109.524 -175.855 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.514 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 28.9 m -105.16 111.43 24.19 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.288 -0.634 . . . . 75.0 109.288 -178.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.511 HG13 HD13 ' A' ' 101' ' ' ILE . 22.4 mm -88.01 126.99 41.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 123.31 0.644 . . . . 73.54 109.335 -175.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -104.2 109.61 21.5 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.227 -1.027 . . . . 62.41 108.227 174.419 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.84 166.24 10.62 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.617 0.767 . . . . 61.21 111.047 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -69.42 142.91 53.75 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 124.214 0.946 . . . . 63.14 110.117 175.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -54.9 -29.25 55.41 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 124.494 1.118 . . . . 71.13 113.429 -173.564 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 90.6 mmm -83.54 -31.72 26.25 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.128 0.571 . . . . 65.01 111.913 -178.584 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' VAL . . . . . 0.545 HG12 HD11 ' A' ' 97' ' ' ILE . 17.9 t -88.23 122.95 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 109.592 -0.521 . . . . 70.21 109.592 -170.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -95.18 152.02 18.71 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.243 0.617 . . . . 61.44 111.281 -166.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -62.3 -26.21 68.29 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.725 0.81 . . . . 73.14 112.683 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -51.74 -33.42 34.62 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.024 0.929 . . . . 72.32 112.487 -178.478 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 43.0 p -91.46 -45.49 8.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.302 0.641 . . . . 74.52 111.416 178.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.545 HD11 HG12 ' A' ' 92' ' ' VAL . 4.9 mt -79.89 -47.15 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 122.409 0.283 . . . . 74.41 110.959 -163.775 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -50.77 -53.17 49.87 Favored Pre-proline 0 N--CA 1.487 1.389 0 N-CA-C 114.845 1.424 . . . . 73.43 114.845 -170.795 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.32 -36.19 95.09 Favored 'Trans proline' 0 C--N 1.385 2.461 0 C-N-CA 121.784 1.656 . . . . 74.34 112.396 -177.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.421 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 45.2 mt-10 -76.83 -30.84 56.52 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 114.819 -1.082 . . . . 64.01 111.503 -177.138 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.511 HD13 HG13 ' A' ' 86' ' ' ILE . 69.1 mt -66.32 -52.7 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 N-CA-C 109.604 -0.517 . . . . 74.44 109.604 173.015 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ILE . . . . . 0.403 HG23 ' HB ' ' A' ' 19' ' ' ILE . 73.6 mt -57.66 -37.41 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 123.967 0.792 . . . . 72.13 110.745 -178.032 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -58.97 -44.22 91.49 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.931 0.893 . . . . 65.53 111.165 175.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 81.8 mt -67.72 -33.35 74.71 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.673 0.789 . . . . 54.12 111.548 177.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.5 HD12 HD11 ' A' ' 63' ' ' LEU . 11.1 mp -70.09 -22.7 63.01 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.14 0.576 . . . . 54.04 110.696 174.225 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' THR . . . . . 0.458 ' HA ' ' HB ' ' A' ' 17' ' ' ILE . 25.3 m -82.45 -35.83 27.15 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 109.459 -0.571 . . . . 73.13 109.459 177.653 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -71.87 -64.23 0.98 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.187 0.595 . . . . 64.21 111.798 178.858 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.453 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 2.8 tt0 -58.79 -48.65 80.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.149 0.579 . . . . 73.21 112.1 -167.181 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.87 -25.46 66.69 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 124.072 0.858 . . . . 55.52 111.919 -176.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.05 -30.1 63.47 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.52 0.728 . . . . 75.53 111.332 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -87.45 -27.44 22.7 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.265 0.626 . . . . 73.2 110.463 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 177.28 123.86 0.81 Allowed Glycine 0 C--N 1.341 0.841 0 N-CA-C 111.492 -0.643 . . . . 54.5 111.492 -176.349 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -26.34 67.86 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.186 0.994 . . . . 73.34 112.118 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -60.59 102.16 0.17 Allowed 'General case' 0 CA--C 1.545 0.781 0 O-C-N 123.507 0.505 . . . . 71.32 110.913 173.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 8.1 p . . . . . 0 C--N 1.353 0.761 0 N-CA-C 109.365 -0.606 . . . . 74.21 109.365 169.873 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.2 mt . . . . . 0 C--O 1.24 0.594 0 N-CA-C 109.965 -0.383 . . . . 74.24 109.965 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -67.67 115.44 7.25 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.229 1.012 . . . . 72.14 109.91 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 40.8 mm -128.99 114.69 33.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 N-CA-C 105.272 -2.121 . . . . 75.35 105.272 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -100.06 137.14 38.92 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 109.273 -0.64 . . . . 64.02 109.273 -172.544 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.2 m -92.15 120.67 32.97 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.832 0.853 . . . . 73.32 109.852 -176.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 71.1 mt -128.62 137.95 51.94 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.135 0.974 . . . . 75.33 108.819 -179.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 44.5 p -87.55 147.25 25.42 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.018 0.527 . . . . 64.25 110.084 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.5 p -109.96 165.92 11.75 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 108.796 -0.816 . . . . 55.33 108.796 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -66.42 -16.68 52.04 Favored 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.008 1.805 . . . . 71.23 111.849 169.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -79.72 135.28 36.49 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.209 1.003 . . . . 65.22 109.347 178.025 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -80.94 147.91 30.06 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.949 0.5 . . . . 73.21 109.747 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.1 m120 55.44 23.91 6.26 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.575 1.15 . . . . 73.2 112.631 -178.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -128.55 121.61 29.18 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 124.742 1.217 . . . . 62.41 107.959 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.6 tp -126.93 125.46 41.58 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.677 -0.49 . . . . 74.12 109.677 -173.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -82.82 107.24 15.29 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.248 1.019 . . . . 71.2 110.462 -177.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -93.46 116.12 28.66 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.203 -1.036 . . . . 75.12 108.203 173.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 43.7 tp -102.75 125.54 49.53 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.52 0.728 . . . . 75.32 109.181 -173.823 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 p -73.71 102.56 4.0 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 107.611 -1.255 . . . . 75.2 107.611 170.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.6 m -82.44 -33.01 28.7 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.981 0.913 . . . . 74.13 111.741 -164.183 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -60.49 -41.14 93.65 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.337 0.655 . . . . 60.53 111.537 177.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.76 7.43 1.39 Allowed Glycine 0 C--N 1.342 0.872 0 CA-C-O 119.097 -0.835 . . . . 62.54 114.032 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -64.31 151.0 44.99 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 117.67 0.735 . . . . 73.14 109.795 175.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 17.0 ttt -125.88 131.07 52.44 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.453 -0.573 . . . . 65.25 109.453 -178.033 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.4 mt -95.05 -46.84 6.64 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.432 0.693 . . . . 73.42 111.462 -171.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLN . . . . . 0.428 ' HB2' HG22 ' A' ' 79' ' ' ILE . 22.5 tp60 . . . . . 0 N--CA 1.483 1.203 0 C-N-CA 123.028 0.531 . . . . 72.04 110.305 175.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 26.0 t . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 120.747 0.308 . . . . 73.42 110.587 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -80.17 155.62 27.34 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.055 0.942 . . . . 75.52 112.103 -174.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.2 m -67.29 107.63 2.45 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.01 0.924 . . . . 73.12 110.147 175.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 39.4 mt -73.85 100.67 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 109.694 -0.484 . . . . 62.53 109.694 -175.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.2 t -84.51 106.67 14.9 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 N-CA-C 107.975 -1.12 . . . . 74.33 107.975 175.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.474 HG23 ' HB3' ' A' ' 57' ' ' LEU . 54.5 mt -95.49 106.87 18.8 Favored 'Isoleucine or valine' 0 C--N 1.34 0.153 0 N-CA-C 107.828 -1.175 . . . . 73.45 107.828 -175.614 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.447 ' HE3' ' HB2' ' A' ' 54' ' ' ASP . 47.1 mtmt -91.64 135.39 33.91 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.161 -0.681 . . . . 72.32 109.161 -177.424 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.444 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 36.1 p30 -63.12 -23.58 67.51 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.169 0.587 . . . . 61.22 111.814 177.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.4 t -80.97 -13.96 58.4 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.898 0.879 . . . . 64.12 111.469 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.447 ' HB2' ' HE3' ' A' ' 51' ' ' LYS . 12.8 t0 -111.38 79.27 1.19 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.116 -1.068 . . . . 65.12 108.116 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -55.58 -32.68 63.26 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 125.627 1.571 . . . . 55.31 113.609 -169.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -62.45 -31.58 72.32 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.076 0.951 . . . . 55.44 111.928 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.474 ' HB3' HG23 ' A' ' 50' ' ' ILE . 75.4 mt -67.77 -35.46 78.74 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.846 0.858 . . . . 75.14 111.518 174.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.98 -48.72 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 108.554 -0.906 . . . . 74.32 108.554 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -54.1 -31.14 51.13 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.803 1.241 . . . . 64.24 112.726 -176.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.5 m170 -86.99 -45.67 10.55 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.059 0.543 . . . . 51.33 110.996 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 22.2 m -87.35 106.1 17.71 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.081 0.553 . . . . 74.43 111.792 -172.246 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.0 ttmm -49.61 -52.2 32.14 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 125.542 1.537 . . . . 74.32 112.726 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.638 HD11 HD12 ' A' ' 105' ' ' LEU . 33.7 tp -61.79 -36.0 79.8 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.699 -1.137 . . . . 71.0 111.451 -177.454 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.429 ' HA ' HD11 ' A' ' 77' ' ' LEU . . . -65.32 -41.3 94.14 Favored 'General case' 0 C--N 1.352 0.703 0 C-N-CA 123.236 0.614 . . . . 75.44 111.161 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 61' ' ' SER . 78.5 mt-30 -56.21 -49.97 72.59 Favored 'General case' 0 C--N 1.352 0.684 0 O-C-N 124.143 0.902 . . . . 74.43 109.901 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.467 ' HB3' HD22 ' A' ' 104' ' ' LEU . 29.5 mm-40 -61.17 -50.75 71.87 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.305 1.042 . . . . 61.45 113.38 179.026 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 74.1 mt -66.17 -46.78 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 C-N-CA 122.839 0.456 . . . . 70.04 111.131 -174.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -70.42 -30.47 67.34 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.867 0.467 . . . . 73.04 112.054 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.9 tp -68.51 -58.79 3.78 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.75 0.42 . . . . 73.34 110.464 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.23 -19.54 56.49 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.563 -0.744 . . . . 71.23 112.015 -175.043 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.496 ' SG ' HG23 ' A' ' 97' ' ' ILE . 63.8 m -139.45 81.32 20.54 Favored Pre-proline 0 CA--C 1.554 1.127 0 N-CA-C 109.103 -0.703 . . . . 72.44 109.103 176.666 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.4 -6.93 16.18 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 122.988 2.459 . . . . 64.43 113.749 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -79.55 -7.37 88.54 Favored Glycine 0 C--N 1.353 1.475 0 CA-C-O 120.016 -0.325 . . . . 72.32 113.124 178.141 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 98.8 t -79.21 130.61 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 123.609 0.764 . . . . 72.4 109.225 172.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . 0.444 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 20.7 mm-40 -87.09 -46.76 9.49 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.145 0.978 . . . . 72.45 111.478 -176.189 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.7 p -157.88 156.53 31.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.697 -0.683 . . . . 73.55 110.838 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LEU . . . . . 0.429 HD11 ' HA ' ' A' ' 64' ' ' ALA . 38.8 mt -108.18 167.21 10.17 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 107.931 -1.137 . . . . 73.32 107.931 171.787 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.587 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.9 ttm -142.8 103.89 4.26 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 106.871 -1.529 . . . . 70.11 106.871 169.64 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.487 HD13 HD13 ' A' ' 84' ' ' LEU . 28.9 mm -77.21 100.74 2.84 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 N-CA-C 107.73 -1.211 . . . . 73.34 107.73 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.15 173.02 32.63 Favored Glycine 0 C--O 1.241 0.568 0 N-CA-C 110.645 -0.982 . . . . 70.11 110.645 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -55.68 -66.61 0.39 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.901 0.881 . . . . 42.05 110.351 -173.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -105.05 -0.74 26.46 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 114.144 -1.389 . . . . 72.02 110.984 -176.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -137.7 168.16 20.24 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 122.947 0.499 . . . . 74.35 111.709 -166.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.487 HD13 HD13 ' A' ' 79' ' ' ILE . 48.9 tp -139.4 114.19 9.34 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.23 1.012 . . . . 70.15 108.71 176.301 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.587 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 31.0 m -96.13 106.63 18.84 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.481 -0.933 . . . . 74.44 108.481 -178.271 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.532 HG13 HD13 ' A' ' 101' ' ' ILE . 20.2 mm -87.87 117.96 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 108.103 -1.073 . . . . 65.11 108.103 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -104.58 125.7 50.96 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 107.522 -1.288 . . . . 70.43 107.522 174.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.403 ' HA ' ' H ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -134.46 169.89 16.57 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.553 0.741 . . . . 62.52 110.841 -174.911 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -81.37 142.51 32.96 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 115.535 -0.757 . . . . 71.01 109.263 178.792 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -80.25 0.96 30.41 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.893 0.877 . . . . 74.3 112.906 -173.559 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 23.1 ptp -78.34 -22.53 47.9 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 120.679 0.276 . . . . 73.25 110.552 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 18.9 t -102.54 147.35 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 123.743 0.817 . . . . 61.23 109.666 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -76.14 158.67 31.49 Favored 'General case' 0 CA--C 1.564 1.488 0 C-N-CA 124.1 0.96 . . . . 62.22 110.618 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 2.2 m95 -82.04 -56.03 4.2 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.703 0.801 . . . . 72.12 112.179 -179.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -60.8 -18.8 57.54 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 124.563 1.145 . . . . 72.34 112.276 -177.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 71.9 p -77.04 -39.29 50.61 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.673 0.789 . . . . 74.13 110.647 177.788 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.496 HG23 ' SG ' ' A' ' 71' ' ' CYS . 28.8 mt -79.93 -29.55 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.281 0 C-N-CA 123.631 0.772 . . . . 74.33 110.655 178.56 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -57.74 -45.2 99.84 Favored Pre-proline 0 CA--C 1.578 2.029 0 N-CA-C 114.608 1.336 . . . . 74.21 114.608 -169.726 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -62.72 -32.81 78.28 Favored 'Trans proline' 0 C--N 1.398 3.169 0 CA-C-N 122.185 1.816 . . . . 73.35 111.557 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -63.29 -51.25 66.86 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.888 0.875 . . . . 73.55 110.019 174.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.532 HD13 HG13 ' A' ' 86' ' ' ILE . 83.2 mt -58.65 -56.05 19.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.495 0.718 . . . . 74.22 110.684 -178.016 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 67.4 mt -55.61 -39.57 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 C-N-CA 123.727 0.811 . . . . 73.31 111.173 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.72 -50.95 69.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.336 0.654 . . . . 75.41 111.01 178.572 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.467 HD22 ' HB3' ' A' ' 66' ' ' GLN . 74.4 mt -67.13 -32.7 74.0 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.11 0.964 . . . . 73.32 111.883 -176.705 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.638 HD12 HD11 ' A' ' 63' ' ' LEU . 9.5 mp -69.88 -29.17 66.32 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.683 0.793 . . . . 65.14 109.998 173.555 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 52.4 m -74.94 -45.51 41.93 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 109.689 -0.485 . . . . 71.52 109.689 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -60.04 -49.89 75.87 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.166 0.986 . . . . 74.25 110.793 -176.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.551 HE21 ' HA ' ' A' ' 115' ' ' VAL . 36.4 tt0 -53.29 -59.2 4.87 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 124.395 1.059 . . . . 73.41 111.065 177.18 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 59.7 mt -72.94 -13.5 61.26 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 114.915 -1.039 . . . . 64.21 111.691 -172.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.36 -27.76 59.29 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.98 0.912 . . . . 74.21 111.143 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -87.41 -43.95 11.71 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.076 0.55 . . . . 75.44 109.571 173.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -178.13 159.21 24.61 Favored Glycine 0 C--N 1.344 0.983 0 CA-C-N 115.544 -0.753 . . . . 51.2 112.587 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -62.08 -29.0 70.01 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.402 1.081 . . . . 61.4 112.426 -178.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -59.9 140.69 56.49 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.233 1.013 . . . . 72.22 112.626 -172.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.551 ' HA ' HE21 ' A' ' 108' ' ' GLN . 8.6 p . . . . . 0 CA--C 1.544 0.718 0 N-CA-C 108.576 -0.898 . . . . 64.22 108.576 168.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 75.8 mt . . . . . 0 N--CA 1.468 0.464 0 N-CA-C 107.778 -1.193 . . . . 64.34 107.778 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -75.69 112.38 12.0 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.433 0.693 . . . . 72.12 109.877 -169.098 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 44.8 mm -119.97 112.23 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 107.717 -1.216 . . . . 73.12 107.717 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.2 ttmm -91.99 126.55 37.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.932 0.893 . . . . 72.24 109.514 -173.079 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.9 m -90.28 120.6 31.56 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 108.837 -0.801 . . . . 71.11 108.837 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.415 ' HB2' ' HG3' ' A' ' 31' ' ' LYS . 97.7 mt -128.04 139.6 52.44 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.043 0.937 . . . . 62.24 109.071 -179.232 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 72.4 p -83.68 160.94 21.22 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.166 0.586 . . . . 74.44 110.192 177.035 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 43.1 p -115.77 162.25 26.36 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 108.664 -0.865 . . . . 74.21 108.664 175.558 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -58.37 -16.35 28.45 Favored 'Trans proline' 0 C--N 1.377 2.027 0 C-N-CA 122.844 2.363 . . . . 72.33 113.37 167.082 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASN . . . . . 0.445 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 28.0 t-20 -84.26 151.02 25.05 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.308 0.643 . . . . 64.52 110.723 176.34 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -67.04 -52.85 37.25 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 124.304 1.042 . . . . 62.13 112.594 -176.824 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -106.97 18.72 21.44 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.678 0.791 . . . . 73.23 111.253 -168.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.445 ' HB3' ' HB3' ' A' ' 26' ' ' ASN . . . -111.94 128.34 56.13 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.535 0.734 . . . . 34.43 109.272 177.15 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.9 tp -137.56 116.23 12.16 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 107.296 -1.372 . . . . 72.33 107.296 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 85' ' ' THR . 60.9 pttt -94.87 150.07 20.57 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.442 0.639 . . . . 74.14 111.194 -176.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -124.32 122.52 37.94 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.569 1.147 . . . . 60.23 108.113 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 26.7 tp -104.12 126.64 51.39 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 124.003 0.921 . . . . 72.01 109.613 -165.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.5 p -85.24 106.56 16.75 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.424 0.689 . . . . 65.33 109.142 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.6 p -96.14 -8.42 33.27 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.385 0.674 . . . . 63.03 112.66 -170.008 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.32 -32.8 37.91 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.75 0.82 . . . . 74.15 112.858 -169.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 121.41 -23.1 7.68 Favored Glycine 0 N--CA 1.475 1.248 0 N-CA-C 111.048 -0.821 . . . . 71.32 111.048 -171.819 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -68.06 96.76 0.64 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.456 -0.942 . . . . 75.15 108.456 168.08 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.8 ttt -79.71 139.24 37.41 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.593 0.757 . . . . 73.43 109.194 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.579 HD23 HD21 ' A' ' 109' ' ' LEU . 87.9 mt -60.1 -34.55 73.63 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.202 0.601 . . . . 63.45 112.2 -178.01 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.1 tt0 . . . . . 0 C--O 1.24 0.583 0 O-C-N 124.3 1.0 . . . . 65.22 109.672 -177.769 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 76.7 p . . . . . 0 N--CA 1.483 1.193 0 N-CA-C 110.146 -0.316 . . . . 51.35 110.146 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.36 73.14 1.44 Allowed 'General case' 0 N--CA 1.488 1.46 0 CA-C-O 121.432 0.634 . . . . 72.11 111.772 -174.222 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.2 m 51.85 69.33 0.68 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.286 1.034 . . . . 72.24 111.488 -178.512 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 57.6 mt -75.85 99.21 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.587 -0.523 . . . . 62.41 109.587 -175.57 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 94.0 t -80.25 124.2 37.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 108.196 -1.038 . . . . 65.41 108.196 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.7 mt -105.02 109.37 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 108.29 -1.004 . . . . 72.44 108.29 -179.468 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -79.6 140.2 37.22 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.736 -0.468 . . . . 73.44 109.736 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -65.75 -23.83 66.82 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.784 0.433 . . . . 75.55 111.388 176.106 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -85.58 -19.61 30.8 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.725 0.81 . . . . 61.21 111.791 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -92.35 95.39 9.65 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 108.572 -0.899 . . . . 73.23 108.572 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -53.08 -40.15 63.85 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.369 1.068 . . . . 72.23 113.023 178.185 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -67.43 -44.15 79.43 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.514 0.726 . . . . 73.31 112.162 -169.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 97.7 mt -61.84 -35.09 77.25 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.464 0.706 . . . . 53.02 111.31 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.507 HG22 ' HG2' ' A' ' 65' ' ' GLN . 53.7 mt -77.71 -34.0 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 CA-C-N 115.068 -0.969 . . . . 72.33 110.205 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -59.62 -36.44 76.32 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.181 0.592 . . . . 70.3 111.268 174.1 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.7 m170 -74.75 -39.23 61.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.499 0.72 . . . . 64.02 111.117 178.242 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 43.7 t -104.45 98.78 8.51 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.431 0.692 . . . . 73.25 110.646 -176.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -61.13 -32.31 72.01 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.939 0.496 . . . . 73.5 110.659 173.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.0 tp -58.27 -40.33 81.56 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.024 0.93 . . . . 64.41 110.713 174.056 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.04 -40.93 91.42 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.209 0.604 . . . . 64.13 111.544 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.507 ' HG2' HG22 ' A' ' 58' ' ' ILE . 91.9 mt-30 -55.68 -47.08 77.35 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.901 0.751 . . . . 73.33 110.162 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -62.99 -51.03 68.44 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.956 -1.02 . . . . 72.31 112.84 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -65.05 -45.83 93.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.062 0.545 . . . . 64.35 111.291 -174.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -69.37 -33.06 72.49 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.791 0.436 . . . . 71.02 112.053 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 52.8 tp -70.99 -42.69 69.32 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.709 0.404 . . . . 74.43 111.192 177.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLN . . . . . 0.451 HE22 HD21 ' A' ' 104' ' ' LEU . 78.7 mt-30 -74.95 -26.67 59.77 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.164 0.586 . . . . 72.44 111.475 -178.003 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.5 t -146.88 103.58 3.88 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 122.826 0.45 . . . . 74.03 110.074 178.42 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -78.73 7.23 4.36 Favored 'Trans proline' 0 C--N 1.373 1.866 0 C-N-CA 122.757 2.305 . . . . 63.54 112.928 173.862 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -78.51 -25.76 60.39 Favored Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.149 -0.38 . . . . 71.44 112.149 171.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 42.2 t -69.43 121.96 19.97 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.186 0.594 . . . . 52.14 110.167 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -74.49 -48.33 27.89 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.252 1.021 . . . . 74.24 110.538 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 62.0 p -162.81 166.42 24.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.607 -1.178 . . . . 62.22 110.326 -173.652 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.2 mt -111.69 169.86 8.54 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.0 -1.111 . . . . 75.32 108.0 171.322 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.528 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 56.0 ttm -143.14 115.43 8.46 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.517 -1.29 . . . . 72.35 107.517 170.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.541 HD13 HD13 ' A' ' 84' ' ' LEU . 42.7 mm -84.89 104.64 13.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 107.943 -1.132 . . . . 51.53 107.943 179.333 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -85.46 173.31 47.75 Favored Glycine 0 C--O 1.244 0.751 0 N-CA-C 109.442 -1.463 . . . . 52.13 109.442 167.766 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.32 -52.39 64.88 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.224 0.61 . . . . 64.22 110.724 -176.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -123.96 5.06 8.67 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 115.368 -0.833 . . . . 73.34 111.879 -176.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -140.2 133.92 30.41 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.982 0.513 . . . . 74.1 110.379 -175.045 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.663 HD23 HD11 ' A' ' 105' ' ' LEU . 32.8 tp -103.27 114.61 29.03 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 109.445 -0.576 . . . . 60.44 109.445 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.528 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 18.4 m -97.81 113.27 25.02 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.35 0.66 . . . . 73.31 109.558 -177.429 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.608 HG13 HD13 ' A' ' 101' ' ' ILE . 30.1 mm -89.01 128.35 41.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 108.307 -0.997 . . . . 74.44 108.307 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -117.94 110.94 18.33 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 108.366 -0.976 . . . . 71.43 108.366 -177.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' LYS . . . . . 0.497 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -117.26 174.28 6.21 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.053 0.541 . . . . 72.41 111.332 -174.467 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -74.02 131.71 41.65 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 108.511 -0.922 . . . . 61.11 108.511 172.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -56.35 -30.37 62.56 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.958 1.096 . . . . 73.3 113.958 -172.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.7 mtp -76.79 -9.33 58.6 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.98 0.512 . . . . 73.41 112.228 -176.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 39.6 t -95.77 138.62 20.86 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.323 1.049 . . . . 54.42 108.475 176.212 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -79.46 160.5 26.56 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.349 0.66 . . . . 75.34 111.165 -176.216 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 22.7 m95 -80.3 -51.87 8.38 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.115 0.566 . . . . 72.23 112.124 176.192 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -60.9 -18.19 55.05 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.786 0.834 . . . . 70.44 112.663 -171.753 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.9 m -71.46 -49.68 39.1 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.335 0.654 . . . . 62.14 110.717 175.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 6.7 mt -85.23 -31.1 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 CA-C-N 115.234 -0.893 . . . . 73.23 111.043 -173.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.2 ttpm? -53.66 -50.11 85.18 Favored Pre-proline 0 CA--C 1.559 1.309 0 C-N-CA 124.566 1.146 . . . . 74.13 113.993 -167.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -58.96 -35.86 97.85 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 122.014 1.81 . . . . 75.33 112.329 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.93 -37.86 82.18 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.601 -0.727 . . . . 74.11 110.668 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.608 HD13 HG13 ' A' ' 86' ' ' ILE . 69.3 mt -65.51 -54.05 32.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 123.676 0.79 . . . . 70.24 109.677 177.564 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 87.3 mt -54.32 -39.34 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 124.053 0.941 . . . . 62.24 111.317 -177.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.13 -49.1 75.74 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 115.087 -0.96 . . . . 72.15 111.3 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.451 HD21 HE22 ' A' ' 70' ' ' GLN . 95.0 mt -65.49 -33.46 76.0 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.75 0.82 . . . . 61.43 112.471 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.663 HD11 HD23 ' A' ' 84' ' ' LEU . 9.7 mp -71.78 -27.26 62.83 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.251 0.62 . . . . 53.2 111.324 175.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.1 m -72.28 -32.47 66.65 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 109.379 -0.601 . . . . 73.13 109.379 173.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.454 ' HA ' ' HE2' ' A' ' 107' ' ' LYS . 9.1 mmpt? -69.28 -45.62 69.21 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.454 0.701 . . . . 64.24 111.105 177.513 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.599 HE21 ' HB ' ' A' ' 115' ' ' VAL . 1.1 tm0? -61.12 -54.24 47.02 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.902 0.881 . . . . 64.41 109.314 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' LEU . . . . . 0.579 HD21 HD23 ' A' ' 40' ' ' LEU . 97.7 mt -74.37 -14.67 60.9 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 114.729 -1.123 . . . . 73.53 112.26 -174.28 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.59 -35.81 78.89 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.993 0.517 . . . . 64.32 110.355 171.975 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' TYR . . . . . 0.502 ' HB2' ' HG2' ' A' ' 113' ' ' GLU . 93.0 m-85 -87.09 -34.6 19.08 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.486 -0.779 . . . . 64.2 109.713 171.29 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 79.78 52.02 4.87 Favored Glycine 0 C--N 1.349 1.292 0 N-CA-C 110.685 -0.966 . . . . 51.52 110.685 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' GLU . . . . . 0.502 ' HG2' ' HB2' ' A' ' 111' ' ' TYR . 32.5 mm-40 -82.35 154.73 25.11 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.521 0.728 . . . . 75.34 112.412 -172.301 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -89.05 98.72 11.92 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 106.202 -1.777 . . . . 73.24 106.202 159.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' VAL . . . . . 0.599 ' HB ' HE21 ' A' ' 108' ' ' GLN . 3.5 p . . . . . 0 N--CA 1.487 1.413 0 C-N-CA 125.653 1.581 . . . . 75.21 114.677 -168.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 85.6 mt . . . . . 0 C--O 1.237 0.443 0 N-CA-C 109.431 -0.581 . . . . 74.33 109.431 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -67.61 127.98 34.74 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 114.591 -1.186 . . . . 74.22 109.761 -173.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.1 mm -119.95 118.71 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 106.491 -1.67 . . . . 60.33 106.491 -175.467 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -95.06 129.75 42.03 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.23 -1.026 . . . . 71.44 108.23 -175.278 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.6 t -100.56 130.86 46.68 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.489 0.716 . . . . 50.5 109.379 -178.079 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.1 mt -126.67 138.82 53.47 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.377 1.071 . . . . 74.23 108.668 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 40.1 p -73.71 149.2 42.01 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.458 0.703 . . . . 61.03 110.897 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 72.6 p -122.89 167.57 14.15 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.819 1.248 . . . . 64.12 108.028 -176.687 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' PRO . . . . . 0.425 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 17.9 Cg_endo -56.78 -18.19 26.1 Favored 'Trans proline' 0 C--N 1.39 2.735 0 C-N-CA 122.364 2.042 . . . . 65.51 113.426 177.645 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -109.61 133.24 53.33 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.602 0.761 . . . . 71.4 109.466 176.454 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.33 -21.76 62.88 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.283 0.633 . . . . 71.13 110.185 166.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -59.95 -47.23 86.65 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.608 1.563 . . . . 73.03 110.469 173.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.55 160.52 15.0 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 114.3 -1.318 . . . . 52.15 110.181 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.0 tp -158.18 128.55 6.17 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.787 -0.82 . . . . 75.03 108.787 173.178 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -82.37 127.01 32.83 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.988 0.915 . . . . 73.23 110.358 -176.164 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' PHE . . . . . 0.45 ' CZ ' ' HG3' ' A' ' 98' ' ' LYS . 80.1 m-85 -114.75 116.71 29.09 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.562 1.145 . . . . 73.54 108.344 175.058 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.0 tp -114.8 129.96 56.78 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 124.069 0.948 . . . . 74.2 109.33 -169.693 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.8 t -100.02 103.87 15.43 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 108.126 -1.064 . . . . 42.35 108.126 174.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.0 p -104.24 -6.61 20.76 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.096 0.958 . . . . 73.42 109.754 176.262 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.85 -60.42 3.68 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 124.648 1.179 . . . . 70.3 111.725 -168.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -161.1 -81.54 0.04 OUTLIER Glycine 0 C--N 1.338 0.678 0 N-CA-C 111.114 -0.794 . . . . 52.14 111.114 176.748 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.21 119.91 17.08 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.471 0.708 . . . . 42.34 109.659 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 48.4 ttp -97.38 155.61 16.83 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.04 -0.982 . . . . 73.42 109.332 -176.587 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.1 mt -58.68 -62.29 1.97 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.115 1.154 . . . . 74.51 114.115 -169.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 . . . . . 0 N--CA 1.484 1.235 0 CA-C-O 119.233 -0.413 . . . . 52.01 110.693 -174.086 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.1 t . . . . . 0 CA--C 1.548 0.897 0 CA-C-O 121.009 0.433 . . . . 63.33 110.623 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.06 -179.02 5.16 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.185 0.994 . . . . 74.54 109.635 176.19 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.8 m -74.61 93.98 2.6 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.435 0.694 . . . . 54.25 110.604 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.506 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 46.6 mt -81.44 97.07 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 N-CA-C 109.126 -0.694 . . . . 65.53 109.126 175.621 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.1 t -84.21 107.87 15.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 108.48 -0.933 . . . . 62.42 108.48 -178.278 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ILE . . . . . 0.506 HG23 ' HB2' ' A' ' 57' ' ' LEU . 55.5 mt -105.61 109.51 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 107.138 -1.43 . . . . 75.12 107.138 174.401 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -93.48 171.62 8.79 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.507 -0.553 . . . . 63.44 109.507 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -56.75 -25.74 55.61 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.248 1.019 . . . . 73.42 112.638 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.8 t -87.12 -17.07 33.64 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.031 0.932 . . . . 64.24 111.466 -178.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -84.17 60.09 5.72 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.407 0.683 . . . . 74.14 110.43 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -61.27 -24.54 66.46 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.278 1.031 . . . . 72.43 111.577 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -56.18 -51.87 66.44 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.851 0.861 . . . . 73.11 110.218 172.307 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.506 ' HB2' HG23 ' A' ' 50' ' ' ILE . 21.8 mt -78.58 -34.95 46.5 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 114.312 -1.313 . . . . 64.22 110.194 -172.974 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 78.5 mt -62.88 -47.43 92.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.86 0.864 . . . . 71.14 110.619 176.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -66.29 -15.63 63.37 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.823 0.675 . . . . 62.04 112.823 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -87.64 -8.86 55.65 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.726 0.411 . . . . 71.55 111.955 173.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.1 t -130.39 102.18 6.07 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.579 0.752 . . . . 75.44 109.175 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -58.49 -28.37 65.33 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.106 0.562 . . . . 65.24 110.627 176.33 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.631 HD11 HD12 ' A' ' 105' ' ' LEU . 40.2 tp -62.35 -48.06 81.48 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.501 0.501 . . . . 73.45 110.358 174.549 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.81 -45.33 90.18 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 124.075 0.859 . . . . 75.11 110.075 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -57.74 -44.31 85.98 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 124.357 1.036 . . . . 71.12 111.018 178.164 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.448 ' HB3' HD22 ' A' ' 104' ' ' LEU . 92.8 mm-40 -68.31 -36.32 79.15 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.339 0.656 . . . . 63.01 112.308 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 93.3 mt -67.77 -46.79 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.077 0.551 . . . . 72.43 109.984 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -71.4 -21.73 61.96 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 123.272 0.629 . . . . 63.41 111.694 176.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.11 -53.1 7.76 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.265 0.626 . . . . 65.33 110.491 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -84.95 -17.74 36.78 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.541 -0.754 . . . . 72.13 111.525 -174.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' CYS . . . . . 0.504 ' SG ' HG23 ' A' ' 97' ' ' ILE . 62.2 m -141.34 90.13 9.18 Favored Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 123.251 0.621 . . . . 55.31 109.602 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -75.31 -1.6 11.5 Favored 'Trans proline' 0 C--N 1.374 1.905 0 C-N-CA 122.784 2.323 . . . . 61.44 113.1 178.365 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.07 -22.58 77.68 Favored Glycine 0 C--N 1.351 1.388 0 N-CA-C 111.692 -0.563 . . . . 71.33 111.692 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.2 t -65.79 121.56 15.09 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 C-N-CA 123.74 0.816 . . . . 65.11 110.098 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -91.08 -40.34 11.67 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.334 1.054 . . . . 63.21 110.436 -176.9 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.2 t -154.18 160.52 41.91 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.595 0.712 . . . . 55.33 111.501 -175.159 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 mt -126.65 138.21 53.39 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.053 1.741 . . . . 75.24 106.803 174.07 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' MET . . . . . 0.417 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 49.9 ttm -116.66 104.63 11.57 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 108.311 -0.996 . . . . 51.31 108.311 172.376 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ILE . . . . . 0.772 HD13 HD13 ' A' ' 84' ' ' LEU . 10.6 mm -84.01 112.37 21.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 107.778 -1.193 . . . . 73.04 107.778 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -96.95 -158.2 31.19 Favored Glycine 0 C--O 1.242 0.627 0 N-CA-C 111.754 -0.538 . . . . 61.4 111.754 177.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.56 -62.1 1.52 Allowed 'General case' 0 C--O 1.244 0.77 0 C-N-CA 123.796 0.838 . . . . 70.25 109.301 174.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.87 -29.81 12.75 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 113.858 -1.519 . . . . 74.34 111.05 -174.709 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -114.64 173.19 6.59 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.275 -0.875 . . . . 72.55 113.182 -160.418 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LEU . . . . . 0.772 HD13 HD13 ' A' ' 79' ' ' ILE . 14.7 tp -144.79 117.4 8.62 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.576 1.55 . . . . 74.04 107.719 175.356 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 85' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 11.3 m -103.62 109.52 21.24 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.914 -0.773 . . . . 60.23 108.914 -175.339 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.587 HG13 HD13 ' A' ' 101' ' ' ILE . 18.6 mm -88.46 117.28 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 108.708 -0.849 . . . . 62.14 108.708 -176.594 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -101.96 128.74 48.24 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 107.79 -1.189 . . . . 71.12 107.79 174.022 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.83 169.91 16.96 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.659 0.384 . . . . 51.22 110.389 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.18 126.81 28.62 Favored 'General case' 0 C--N 1.35 0.609 0 N-CA-C 109.236 -0.654 . . . . 55.34 109.236 178.309 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.6 ptm85 -65.41 -23.17 66.88 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.475 0.917 . . . . 75.52 113.475 -169.052 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.6 mmt -79.19 -21.49 46.29 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.921 0.488 . . . . 74.24 110.937 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.0 t -88.02 145.57 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 108.08 -1.082 . . . . 74.44 108.08 174.442 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -106.95 144.06 34.14 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 112.895 0.702 . . . . 73.41 112.895 -167.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -61.72 -22.99 65.84 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.543 1.137 . . . . 65.44 112.199 174.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -53.42 -32.9 51.79 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.397 1.079 . . . . 74.34 112.119 -178.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.7 t -103.45 -20.79 13.93 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.859 0.864 . . . . 74.53 111.579 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' ILE . . . . . 0.504 HG23 ' SG ' ' A' ' 71' ' ' CYS . 55.5 mt -97.48 -53.65 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 122.886 0.474 . . . . 71.31 111.344 -170.259 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' LYS . . . . . 0.45 ' HG3' ' CZ ' ' A' ' 32' ' ' PHE . 3.8 ttpm? -52.48 -47.77 92.3 Favored Pre-proline 0 N--CA 1.49 1.565 0 N-CA-C 114.026 1.121 . . . . 75.23 114.026 -173.053 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.33 -40.98 82.71 Favored 'Trans proline' 0 C--N 1.394 2.972 0 C-N-CA 122.121 1.881 . . . . 71.51 112.205 177.282 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 11.2 mm-40 -69.58 -38.05 77.19 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 115.483 -0.781 . . . . 70.34 110.36 -177.515 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.587 HD13 HG13 ' A' ' 86' ' ' ILE . 86.2 mt -60.1 -52.28 63.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.31 0.644 . . . . 70.12 110.322 176.731 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 79.6 mt -56.91 -39.24 63.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.462 0.705 . . . . 42.11 111.026 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -64.25 -42.35 96.54 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.147 0.979 . . . . 71.52 111.33 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.524 HD23 ' HE2' ' A' ' 107' ' ' LYS . 89.6 mt -64.7 -43.67 92.74 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.497 0.719 . . . . 72.14 110.765 176.71 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' LEU . . . . . 0.631 HD12 HD11 ' A' ' 63' ' ' LEU . 11.0 mp -66.88 -24.9 66.17 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.728 0.811 . . . . 71.1 111.164 178.557 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 82.9 m -77.39 -48.93 16.0 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.448 0.699 . . . . 65.52 110.42 178.439 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' LYS . . . . . 0.524 ' HE2' HD23 ' A' ' 104' ' ' LEU . 0.1 OUTLIER -68.14 -40.36 82.47 Favored 'General case' 0 C--N 1.358 0.968 0 O-C-N 123.337 0.398 . . . . 72.52 110.969 -174.16 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 108' ' ' GLN . . . . . 0.621 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 20.7 tt0 -55.84 -58.71 6.73 Favored 'General case' 0 C--N 1.358 0.938 0 O-C-N 123.916 0.76 . . . . 65.42 110.35 177.309 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 86.8 mt -71.64 -10.8 60.31 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 114.841 -1.072 . . . . 72.44 111.764 -173.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.71 -37.1 70.69 Favored 'General case' 0 C--N 1.354 0.801 0 C-N-CA 123.269 0.628 . . . . 72.01 111.173 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -110.39 -19.14 13.06 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.143 0.577 . . . . 52.21 111.953 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -119.8 163.11 13.8 Favored Glycine 0 C--N 1.339 0.729 0 N-CA-C 111.016 -0.834 . . . . 54.21 111.016 -176.873 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -102.88 -24.19 13.7 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.356 0.662 . . . . 73.01 110.168 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -114.27 158.84 20.87 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.787 0.835 . . . . 75.2 111.474 -167.779 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 5.8 p . . . . . 0 CA--C 1.552 1.037 0 C-N-CA 123.891 0.877 . . . . 74.13 111.123 174.829 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.3 mtp . . . . . 0 N--CA 1.483 1.211 0 N-CA-C 110.119 -0.326 . . . . 65.32 110.119 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 158.65 77.1 0.02 OUTLIER Glycine 0 C--N 1.348 1.238 0 N-CA-C 112.121 -0.392 . . . . 61.22 112.121 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -66.12 99.4 0.51 Allowed 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.57 0.7 . . . . 63.34 110.207 175.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 47.1 t60 -119.26 -0.98 10.89 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.0 0.52 . . . . 62.14 111.293 -176.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -66.05 140.96 58.3 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.668 0.387 . . . . 61.03 110.345 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -155.04 154.97 33.28 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.091 0.556 . . . . 73.11 110.045 -174.471 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -139.56 134.97 32.9 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.805 -0.813 . . . . 62.01 108.805 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -109.11 148.44 30.86 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 122.955 0.502 . . . . 75.54 110.837 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.9 t -75.28 171.79 13.58 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.96 0.904 . . . . 64.53 111.083 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -92.05 120.01 32.27 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.096 0.558 . . . . 65.43 110.87 -174.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 17.7 ptp -111.06 86.45 2.32 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 107.94 -1.133 . . . . 70.34 107.94 169.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -104.26 171.58 7.26 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 114.712 -1.131 . . . . 74.33 111.297 -171.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -103.3 10.66 37.44 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.13 0.972 . . . . 71.55 110.522 176.16 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -108.28 96.5 6.4 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.053 0.941 . . . . 71.13 109.42 -176.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 -78.63 6.16 9.42 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 113.639 0.977 . . . . 71.54 113.639 -176.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -129.99 140.13 50.94 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 109.112 -0.699 . . . . 74.35 109.112 175.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.433 ' H ' HG23 ' A' ' 106' ' ' THR . 66.9 mt -120.11 117.13 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 107.478 -1.305 . . . . 55.53 107.478 177.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -64.88 124.7 22.7 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 123.75 0.656 . . . . 74.42 109.725 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.444 ' HB ' HG23 ' A' ' 102' ' ' ILE . 50.3 mm -116.03 127.37 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 N-CA-C 107.313 -1.366 . . . . 73.53 107.313 -174.188 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -93.63 150.13 20.67 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 108.494 -0.928 . . . . 71.42 108.494 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.9 t -141.28 112.23 7.22 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.695 0.798 . . . . 30.22 109.233 173.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.8 mt -99.65 138.97 35.99 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 124.075 0.95 . . . . 72.32 110.33 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.0 p -80.22 140.2 36.38 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 123.748 0.655 . . . . 72.34 109.453 176.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 63.9 p -107.09 166.08 11.7 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.539 1.136 . . . . 73.34 108.712 -176.676 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.71 -7.93 19.67 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.375 2.05 . . . . 75.12 112.743 169.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -82.65 151.14 26.42 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.222 1.009 . . . . 74.33 111.628 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -89.4 -31.58 17.68 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.086 0.954 . . . . 72.12 112.357 -171.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -121.82 2.3 9.99 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.269 0.627 . . . . 75.31 111.921 -174.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -112.54 137.53 50.64 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.91 0.484 . . . . 61.43 110.121 177.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.4 tp -136.99 134.59 36.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.993 0.517 . . . . 72.53 109.958 177.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.599 ' HE2' HD12 ' A' ' 33' ' ' LEU . 88.6 tttt -92.2 120.34 32.68 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.296 1.038 . . . . 72.13 110.629 -175.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -109.81 109.04 19.58 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.296 -1.002 . . . . 73.32 108.296 173.025 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.599 HD12 ' HE2' ' A' ' 31' ' ' LYS . 4.5 tt -111.94 134.18 53.66 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.366 -0.976 . . . . 72.33 108.366 -175.146 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.3 m -85.93 111.96 20.73 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.278 0.631 . . . . 63.25 110.006 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.523 HG23 HD22 ' A' ' 33' ' ' LEU . 26.3 p -135.21 90.94 2.68 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.838 0.855 . . . . 72.31 110.284 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -174.26 -58.59 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.168 0.587 . . . . 55.05 110.717 176.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.53 -72.32 0.03 OUTLIER Glycine 0 C--N 1.342 0.912 0 CA-C-N 115.695 -0.684 . . . . 63.44 111.528 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.425 ' HB2' ' HB3' ' A' ' 109' ' ' LEU . 25.0 mm-40 -99.74 167.1 10.77 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.182 0.515 . . . . 52.14 111.195 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.446 ' HE2' ' HB2' ' A' ' 39' ' ' MET . 24.1 ptm -131.44 167.66 18.94 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.07 1.348 . . . . 71.53 108.672 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.416 HD23 HD21 ' A' ' 109' ' ' LEU . 90.2 mt -75.51 -66.69 0.74 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 122.738 0.415 . . . . 75.3 111.191 -173.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -121.53 136.59 54.94 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.264 0.626 . . . . 63.44 109.426 -172.018 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 5.3 p -59.18 135.55 57.67 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 122.928 0.491 . . . . 71.4 111.667 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -63.74 129.73 41.32 Favored 'General case' 0 C--N 1.35 0.618 0 C-N-CA 123.685 0.794 . . . . 73.14 111.194 -177.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.35 1.57 18.26 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.486 -0.779 . . . . 51.5 111.645 -175.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.3 m -98.22 -174.81 2.94 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.806 0.843 . . . . 72.44 110.097 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 23.1 pttm -109.26 162.06 14.66 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.743 0.417 . . . . 63.22 110.712 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' A' ' 79' ' ' ILE . 17.9 p -83.37 97.01 8.71 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.393 0.677 . . . . 44.34 109.555 175.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 56.9 mt -86.06 121.2 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.919 0.888 . . . . 70.11 110.58 -174.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -89.5 108.65 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 N-CA-C 109.591 -0.522 . . . . 72.03 109.591 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 60.7 mt -97.16 110.2 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.915 -0.772 . . . . 71.22 108.915 -176.746 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -93.74 151.93 19.29 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.288 0.635 . . . . 71.42 110.059 -175.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.466 ' HA ' HD11 ' A' ' 58' ' ' ILE . 9.1 p30 -66.36 -22.68 66.26 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.722 0.409 . . . . 71.4 111.483 178.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.4 p -83.35 -32.81 26.05 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.578 0.751 . . . . 64.0 110.726 176.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.4 75.06 9.84 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.816 0.846 . . . . 75.42 109.513 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -64.52 -28.58 69.75 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 114.625 -1.17 . . . . 63.4 113.588 -172.038 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -60.69 -38.29 84.5 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.584 0.629 . . . . 63.21 110.814 -179.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 78.5 mt -69.78 -38.5 76.73 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.421 0.688 . . . . 74.52 110.953 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.507 HG22 ' HG2' ' A' ' 65' ' ' GLN . 52.2 mt -62.65 -46.26 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.939 0.896 . . . . 50.33 110.246 175.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -58.86 -31.41 68.52 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.645 1.178 . . . . 63.23 111.692 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -70.36 -34.29 72.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.248 0.619 . . . . 74.41 111.463 177.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.506 ' HB2' HG12 ' A' ' 116' ' ' ILE . 39.2 t -113.17 105.04 12.97 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.479 0.712 . . . . 70.2 110.154 -175.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -56.98 -31.89 65.51 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.414 0.686 . . . . 71.43 110.748 174.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.477 HD11 HD12 ' A' ' 105' ' ' LEU . 43.9 tp -63.14 -44.52 95.31 Favored 'General case' 0 C--N 1.348 0.538 0 C-N-CA 124.095 0.958 . . . . 71.44 110.535 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.71 97.06 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 123.272 0.629 . . . . 71.02 110.698 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.507 ' HG2' HG22 ' A' ' 58' ' ' ILE . 68.9 mt-30 -56.93 -44.53 82.57 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 124.355 1.035 . . . . 71.24 110.846 177.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 18.8 mm100 -68.32 -36.78 79.81 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.434 0.693 . . . . 64.51 111.987 179.249 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 81.3 mt -68.72 -48.67 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.28 0.632 . . . . 64.4 111.027 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -66.97 -30.6 70.77 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.693 0.397 . . . . 72.14 111.289 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.5 tp -72.37 -52.41 16.19 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.198 0.599 . . . . 55.34 111.291 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 27.0 mt-30 -85.02 -29.23 25.14 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.629 0.771 . . . . 75.35 111.937 -172.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 58.9 m -118.98 87.35 33.73 Favored Pre-proline 0 CA--C 1.544 0.749 0 N-CA-C 107.72 -1.215 . . . . 64.12 107.72 177.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.07 -17.77 45.78 Favored 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 123.11 2.54 . . . . 75.41 113.456 -172.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.5 -12.89 83.96 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-O 119.14 -0.811 . . . . 43.41 114.364 -177.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.4 t -70.64 123.32 24.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-N 117.491 0.646 . . . . 65.42 110.7 -175.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -81.22 -50.78 9.16 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.693 1.197 . . . . 74.22 110.168 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 56.7 p -157.62 163.65 38.05 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 114.637 -1.165 . . . . 72.34 110.911 -173.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.4 mt -119.27 164.94 14.9 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 124.761 1.224 . . . . 71.14 108.533 177.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.56 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 56.0 ttm -138.33 108.43 6.4 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 107.982 -1.118 . . . . 73.23 107.982 166.067 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.75 HD13 HD13 ' A' ' 84' ' ' LEU . 23.0 mm -83.81 102.05 9.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 108.465 -0.939 . . . . 70.24 108.465 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.38 -173.69 48.43 Favored Glycine 0 C--O 1.241 0.574 0 N-CA-C 110.511 -1.036 . . . . 74.23 110.511 173.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.74 -63.49 1.05 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.159 -0.682 . . . . 71.44 109.159 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -95.57 -21.59 18.16 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.025 0.53 . . . . 64.42 111.563 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -120.13 169.68 10.01 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.738 0.644 . . . . 73.41 112.738 -168.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.75 HD13 HD13 ' A' ' 79' ' ' ILE . 18.0 tp -142.79 117.64 9.92 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.164 1.386 . . . . 62.13 107.827 176.599 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.56 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 58.4 m -96.95 109.69 22.38 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.811 -0.811 . . . . 64.32 108.811 -177.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 25.8 mm -89.33 124.13 41.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.448 -0.945 . . . . 64.0 108.448 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -109.86 127.95 55.03 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.394 -1.336 . . . . 64.3 107.394 175.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.505 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -130.8 172.29 12.17 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.79 0.436 . . . . 74.32 110.093 -176.874 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.407 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 12.5 t70 -81.44 141.94 33.42 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 109.01 -0.737 . . . . 74.15 109.01 172.29 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -66.35 -10.88 47.44 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 113.581 0.956 . . . . 72.05 113.581 -172.343 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' MET . . . . . 0.435 ' HG3' HG23 ' A' ' 92' ' ' VAL . 24.1 ptm -76.04 -28.04 57.52 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.174 0.443 . . . . 54.31 111.144 175.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.435 HG23 ' HG3' ' A' ' 91' ' ' MET . 40.9 t -99.1 127.29 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 109.051 -0.722 . . . . 74.41 109.051 -175.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -95.3 154.12 17.35 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.35 0.66 . . . . 73.31 111.129 -173.016 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.505 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 97.2 m95 -68.04 -13.78 62.46 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.19 0.996 . . . . 72.41 112.598 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -52.5 -35.0 52.02 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.115 0.966 . . . . 73.34 111.876 175.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.4 t -97.26 -32.79 11.73 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.315 0.646 . . . . 74.14 110.826 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 65.1 mt -80.55 -51.27 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 123.509 0.724 . . . . 55.23 110.857 -166.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.468 ' HG3' ' HB3' ' A' ' 94' ' ' TRP . 59.8 mtpt -54.85 -58.45 14.46 Favored Pre-proline 0 N--CA 1.484 1.246 0 CA-C-O 117.583 -1.199 . . . . 74.31 113.064 -174.034 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -59.73 -36.25 92.24 Favored 'Trans proline' 0 C--N 1.398 3.135 0 C-N-CA 121.804 1.669 . . . . 33.21 112.203 -171.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.414 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 53.5 mt-10 -64.91 -46.43 81.74 Favored 'General case' 0 C--N 1.35 0.598 0 O-C-N 123.96 0.788 . . . . 64.52 110.272 177.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.33 -32.18 49.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 123.456 0.703 . . . . 73.5 111.888 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 98' ' ' LYS . 45.0 mm -62.99 -44.0 99.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 N-CA-C 109.165 -0.68 . . . . 72.23 109.165 175.036 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.56 -50.94 70.63 Favored 'General case' 0 C--N 1.354 0.783 0 CA-C-N 114.989 -1.005 . . . . 74.34 110.421 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 96.0 mt -61.85 -39.68 92.7 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.095 0.958 . . . . 71.33 111.567 -177.039 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.477 HD12 HD11 ' A' ' 63' ' ' LEU . 7.6 mp -64.73 -37.39 87.45 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.297 0.639 . . . . 74.13 110.812 176.569 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.433 HG23 ' H ' ' A' ' 17' ' ' ILE . 85.4 m -71.8 -34.09 69.08 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.812 0.445 . . . . 73.34 109.978 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -67.41 -47.49 70.13 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 123.515 0.726 . . . . 75.42 109.994 176.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -48.24 81.29 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 124.22 0.95 . . . . 73.33 109.995 -175.356 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.425 ' HB3' ' HB2' ' A' ' 38' ' ' GLU . 67.3 mt -68.2 -14.24 62.83 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.916 0.76 . . . . 74.34 112.19 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -89.46 -22.15 22.63 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.542 0.737 . . . . 71.2 111.379 174.388 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -90.51 -51.98 5.13 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.229 0.538 . . . . 75.15 110.554 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -142.5 146.98 18.31 Favored Glycine 0 C--N 1.343 0.954 0 CA-C-N 114.974 -1.012 . . . . 62.35 111.835 -175.707 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -77.64 -34.58 53.14 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.591 0.756 . . . . 74.15 111.026 -174.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -97.7 138.82 34.5 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.002 0.521 . . . . 62.3 109.667 170.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.576 HG13 HG13 ' A' ' 116' ' ' ILE . 3.7 p -67.53 -42.75 87.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 123.781 0.832 . . . . 74.34 111.304 -178.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.576 HG13 HG13 ' A' ' 115' ' ' VAL . 54.0 mt -117.54 135.29 58.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 123.268 0.627 . . . . 74.32 109.451 -175.773 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.3 m -62.71 109.07 1.3 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 106.465 -1.68 . . . . 71.11 106.465 163.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -53.69 88.63 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 114.262 1.208 . . . . 72.54 114.262 -154.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 . . . . . 0 CA--C 1.56 1.337 0 C-N-CA 125.688 1.595 . . . . 74.43 112.131 170.248 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.486 1.356 0 N-CA-C 110.275 -0.268 . . . . 72.13 110.275 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -150.91 131.34 3.49 Favored Glycine 0 C--N 1.349 1.262 0 N-CA-C 111.799 -0.52 . . . . 73.52 111.799 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 -128.94 80.33 1.96 Allowed 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 108.088 -1.078 . . . . 74.32 108.088 175.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -83.96 109.93 18.01 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 115.584 -0.735 . . . . 74.41 109.9 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.8 p80 -150.92 84.35 1.34 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.587 0.755 . . . . 72.31 110.04 177.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -161.59 87.65 0.69 Allowed 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.28 -0.873 . . . . 72.43 109.432 174.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -124.45 98.17 5.63 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 108.426 -0.953 . . . . 72.22 108.426 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -107.18 114.0 27.77 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.552 0.741 . . . . 74.11 109.867 -177.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.8 t -121.86 163.38 19.31 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.575 0.75 . . . . 31.33 109.501 175.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.0 p-80 -149.78 147.63 28.24 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.218 -0.66 . . . . 72.21 109.218 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 41.8 tpp -160.94 119.99 2.58 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.291 0.567 . . . . 63.12 110.622 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -129.36 99.35 5.17 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 106.214 -1.772 . . . . 64.22 106.214 168.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.8 t -122.49 45.86 2.27 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 108.017 -1.105 . . . . 72.0 108.017 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -84.2 33.32 0.5 Allowed 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 114.789 -1.096 . . . . 74.22 112.758 -174.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.51 117.61 10.49 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.166 -1.05 . . . . 74.52 108.166 165.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.44 143.44 57.11 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 109.431 -0.581 . . . . 73.24 109.431 173.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.1 mt -95.65 115.9 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 O-C-N 123.569 0.543 . . . . 73.4 111.608 -162.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 3.3 m80 -95.2 145.73 24.83 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.674 0.79 . . . . 73.13 109.018 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.0 mm -129.03 126.78 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 106.75 -1.574 . . . . 74.45 106.75 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -105.75 125.73 51.33 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.311 -0.996 . . . . 51.41 108.311 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.9 t -102.57 113.15 26.27 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 109.101 -0.704 . . . . 61.11 109.101 -177.594 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.8 mt -101.3 140.55 35.44 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.579 0.752 . . . . 44.12 110.321 177.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 28.0 p -85.34 157.69 20.47 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.005 0.522 . . . . 74.44 111.211 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.3 p -126.72 161.48 52.86 Favored Pre-proline 0 CA--C 1.558 1.283 0 C-N-CA 124.762 1.225 . . . . 65.43 108.305 -177.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -61.53 -17.92 56.74 Favored 'Trans proline' 0 C--N 1.383 2.364 0 C-N-CA 122.23 1.953 . . . . 62.04 113.526 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -101.29 132.41 46.83 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 108.684 -0.858 . . . . 61.22 108.684 175.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.09 -16.6 56.52 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.563 0.345 . . . . 61.14 111.918 -176.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -70.6 -38.75 74.04 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 109.41 -0.589 . . . . 72.03 109.41 175.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.48 144.62 26.63 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.499 0.72 . . . . 74.12 110.67 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.5 tp -154.94 124.29 6.38 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.211 -0.663 . . . . 74.01 109.211 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -83.63 121.37 27.16 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.766 0.826 . . . . 63.24 110.837 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -109.4 112.73 25.02 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.299 1.04 . . . . 74.42 108.468 168.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.2 tp -105.01 134.48 48.04 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.27 1.028 . . . . 55.02 109.352 -176.28 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.4 p -74.91 105.25 5.85 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 108.54 -0.911 . . . . 71.14 108.54 172.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.6 m -107.97 39.97 1.84 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.473 1.109 . . . . 74.21 110.025 -168.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -137.16 -156.14 0.67 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.043 -0.98 . . . . 63.14 108.548 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -72.87 -20.62 79.91 Favored Glycine 0 C--N 1.352 1.423 0 CA-C-N 118.295 0.498 . . . . 70.41 113.352 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -94.76 158.7 15.39 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 121.31 0.576 . . . . 55.3 111.633 -176.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.5 ttt -134.25 150.97 51.06 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.604 1.162 . . . . 74.15 109.128 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.546 ' O ' ' HB3' ' A' ' 114' ' ' ASP . 94.1 mt -78.77 -58.07 3.43 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.86 0.689 . . . . 63.12 112.86 -175.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -116.28 -106.11 0.39 Allowed 'General case' 0 N--CA 1.48 1.07 0 O-C-N 121.591 -0.693 . . . . 72.34 109.731 -177.352 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 10.7 t -169.64 143.64 2.76 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 108.704 -0.85 . . . . 62.33 108.704 -176.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -70.43 114.26 8.37 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 107.948 -1.13 . . . . 65.12 107.948 -177.4 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.92 63.52 1.05 Allowed Glycine 0 C--N 1.336 0.533 0 N-CA-C 110.499 -1.04 . . . . 74.45 110.499 -175.457 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.4 t -136.21 -171.94 3.01 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.086 0.554 . . . . 74.12 109.822 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -93.35 142.59 27.15 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.073 0.949 . . . . 52.34 108.669 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.4 m -79.36 83.28 5.41 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 108.726 -0.842 . . . . 71.4 108.726 172.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 52.5 mt -73.93 99.58 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 CA-C-N 115.536 -0.756 . . . . 71.54 109.956 -170.554 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 77' ' ' LEU . 40.0 t -96.31 107.61 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 108.907 -0.775 . . . . 72.04 108.907 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.42 HG23 ' HB2' ' A' ' 57' ' ' LEU . 71.9 mt -105.18 113.46 42.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.436 1.094 . . . . 64.54 108.401 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.6 mtmp? -80.2 161.53 25.15 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 108.862 -0.792 . . . . 72.41 108.862 176.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -64.09 -18.38 64.34 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.668 0.787 . . . . 74.31 111.935 178.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 74.1 p -74.9 -27.77 60.36 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.52 1.128 . . . . 65.4 112.08 175.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.89 69.35 10.55 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.792 0.837 . . . . 61.14 111.225 -172.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -60.12 -29.62 68.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.416 0.686 . . . . 74.23 111.609 -177.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -58.3 -48.46 80.44 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.684 1.194 . . . . 70.44 110.932 175.595 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.42 ' HB2' HG23 ' A' ' 50' ' ' ILE . 89.8 mt -79.05 -29.97 43.8 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 115.517 -0.765 . . . . 72.24 111.227 -177.576 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 93.5 mt -65.84 -43.48 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.874 0.869 . . . . 71.25 109.859 176.184 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.432 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 90.2 m-20 -69.96 -7.72 43.02 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.882 0.697 . . . . 62.52 112.882 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -91.89 -6.12 52.03 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 122.873 0.469 . . . . 73.43 110.946 174.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.509 ' HB3' HG12 ' A' ' 116' ' ' ILE . 19.3 p -140.2 104.78 4.89 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 123.748 0.819 . . . . 70.45 109.596 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 38.6 ttpt -56.69 -29.37 62.3 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.898 0.479 . . . . 74.11 111.461 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.525 HD11 HD12 ' A' ' 105' ' ' LEU . 25.5 tp -59.19 -46.62 87.95 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 123.292 0.637 . . . . 64.51 110.522 178.414 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.53 -47.16 86.61 Favored 'General case' 0 C--N 1.348 0.5 0 O-C-N 124.242 0.964 . . . . 73.24 110.375 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.432 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 97.6 mt-30 -54.4 -46.74 73.2 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.461 1.101 . . . . 75.55 111.57 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 15.0 mm100 -73.58 -35.26 65.42 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 116.043 -0.526 . . . . 74.3 112.027 -177.785 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 65.8 mt -65.45 -46.47 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 122.983 0.513 . . . . 74.42 110.319 177.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -70.08 -28.7 65.64 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.054 0.542 . . . . 73.04 111.71 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.5 tp -69.63 -55.99 8.52 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.727 0.411 . . . . 75.15 110.278 175.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.452 HE22 HD21 ' A' ' 104' ' ' LEU . 78.1 mt-30 -70.6 -26.81 63.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.367 -0.833 . . . . 41.24 110.949 -175.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.717 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 77.6 m -144.25 91.91 6.29 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 123.334 0.654 . . . . 54.44 109.932 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.58 3.01 5.18 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 122.97 2.447 . . . . 50.11 113.691 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -94.26 22.49 36.58 Favored Glycine 0 C--N 1.347 1.16 0 C-N-CA 122.82 0.248 . . . . 60.43 113.244 175.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.428 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 60.5 t -98.75 132.24 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.494 0.718 . . . . 72.53 109.707 172.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -88.61 -48.17 7.75 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.124 0.969 . . . . 71.23 112.602 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 53.9 p -159.25 163.24 36.02 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.859 0.464 . . . . 73.32 111.509 -177.158 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 49' ' ' VAL . 42.3 mt -124.88 125.59 44.21 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 107.983 -1.117 . . . . 63.12 107.983 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.499 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.9 ttm -105.47 112.68 25.86 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 107.657 -1.238 . . . . 63.41 107.657 174.826 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.509 HD12 HG21 ' A' ' 115' ' ' VAL . 18.9 mm -86.71 113.5 24.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.548 0 N-CA-C 107.956 -1.127 . . . . 74.44 107.956 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -84.12 -171.45 47.9 Favored Glycine 0 C--O 1.243 0.663 0 N-CA-C 111.373 -0.691 . . . . 65.14 111.373 174.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -70.12 -60.57 2.21 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.381 -0.599 . . . . 72.44 109.381 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -96.67 -37.09 10.47 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.587 1.155 . . . . 74.33 109.989 178.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -102.92 175.87 5.34 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.512 -1.222 . . . . 75.11 112.529 -165.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.406 HD21 HD11 ' A' ' 86' ' ' ILE . 29.2 tp -129.57 146.6 51.37 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 106.69 -1.596 . . . . 54.01 106.69 173.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.499 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 89.9 m -130.01 110.1 11.38 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.476 -0.935 . . . . 61.13 108.476 174.399 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.549 HG13 HD13 ' A' ' 101' ' ' ILE . 22.5 mm -88.56 118.18 33.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 108.653 -0.869 . . . . 51.3 108.653 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -96.28 116.92 29.79 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 107.9 -1.148 . . . . 65.11 107.9 172.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 19.5 pttp -104.58 175.02 5.63 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.527 0.731 . . . . 71.54 109.354 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -74.74 137.52 42.09 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.154 -0.93 . . . . 75.3 108.732 168.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -36.38 74.53 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.21 1.404 . . . . 74.31 113.002 -176.487 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 66.3 mtt -83.83 -15.17 49.28 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.565 0.746 . . . . 61.33 111.431 -177.713 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.9 t -88.33 144.76 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 109.323 -0.621 . . . . 74.22 109.323 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -105.11 144.56 31.74 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.101 0.961 . . . . 74.14 110.556 -171.526 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 53.1 m95 -66.98 -23.79 65.98 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 114.069 1.137 . . . . 73.11 114.069 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -61.48 -21.34 64.1 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.123 0.569 . . . . 64.54 112.0 -172.642 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -92.88 -33.78 14.08 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.393 0.677 . . . . 71.11 111.71 174.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.717 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 34.6 mt -83.44 -47.29 18.21 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 C-N-CA 123.245 0.618 . . . . 63.42 111.315 -166.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -53.83 -53.23 60.13 Favored Pre-proline 0 N--CA 1.486 1.355 0 CA-C-O 117.651 -1.166 . . . . 54.3 114.015 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -56.87 -37.93 97.07 Favored 'Trans proline' 0 C--N 1.399 3.231 0 C-N-CA 122.142 1.895 . . . . 73.15 111.701 -176.477 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -61.45 -53.78 52.09 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.033 -0.985 . . . . 40.24 110.396 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.549 HD13 HG13 ' A' ' 86' ' ' ILE . 65.0 mt -61.42 -51.94 67.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.904 0 O-C-N 124.132 0.895 . . . . 75.21 111.917 -178.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 98.0 mt -56.45 -43.61 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 123.757 0.823 . . . . 74.22 111.483 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.25 -48.99 79.57 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.906 0.754 . . . . 51.54 110.067 177.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.452 HD21 HE22 ' A' ' 70' ' ' GLN . 84.3 mt -58.39 -44.54 88.97 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 114.656 -1.157 . . . . 72.42 112.087 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.525 HD12 HD11 ' A' ' 63' ' ' LEU . 10.2 mp -65.84 -33.66 76.35 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.571 0.748 . . . . 62.4 111.755 -178.188 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 60.9 m -75.84 -34.68 60.08 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.219 0.608 . . . . 61.45 110.383 -176.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -75.19 -48.55 23.02 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.077 0.551 . . . . 73.44 110.177 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -51.18 -59.9 3.69 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 125.586 1.554 . . . . 75.35 112.483 -176.006 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.4 mt -63.41 -26.88 68.94 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.761 -1.108 . . . . 73.43 110.97 -177.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.98 -10.12 59.35 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.917 0.887 . . . . 65.24 112.268 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -81.46 -15.18 55.81 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 122.61 0.364 . . . . 65.34 110.764 169.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 113.88 -28.7 8.27 Favored Glycine 0 C--N 1.346 1.119 0 CA-C-N 116.135 -0.484 . . . . 42.23 112.101 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -90.42 178.67 6.06 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.621 0.769 . . . . 51.42 112.724 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.546 ' HB3' ' O ' ' A' ' 40' ' ' LEU . 6.2 m-20 -110.23 -170.64 1.68 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.424 -1.262 . . . . 54.33 111.453 -170.237 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.509 HG21 HD12 ' A' ' 79' ' ' ILE . 7.2 p -57.97 -44.53 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.316 1.047 . . . . 64.12 112.196 178.401 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.509 HG12 ' HB3' ' A' ' 61' ' ' SER . 35.3 mt -133.13 152.45 35.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.68 1.192 . . . . 44.11 108.1 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 18.8 m -66.96 89.74 0.17 Allowed 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 109.195 -0.669 . . . . 75.52 109.195 171.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.512 ' H ' ' HD3' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -68.86 93.31 0.54 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.077 0.951 . . . . 53.31 110.718 -178.533 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 . . . . . 0 C--O 1.251 1.138 0 N-CA-C 108.728 -0.841 . . . . 65.35 108.728 -178.959 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.3 mtm . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 110.355 -0.239 . . . . 72.24 110.355 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 128.0 -84.67 0.33 Allowed Glycine 0 C--N 1.348 1.208 0 N-CA-C 111.196 -0.762 . . . . 71.33 111.196 176.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.6 t60 -141.94 135.25 29.21 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.892 0.877 . . . . 70.43 109.119 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -74.32 -78.21 0.1 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 123.298 0.639 . . . . 54.24 112.082 -176.172 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 29.4 m170 -141.0 171.84 13.5 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.839 0.856 . . . . 72.13 111.091 -172.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -93.98 142.07 27.8 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.75 0.82 . . . . 61.23 110.745 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -71.97 135.13 46.33 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.612 0.765 . . . . 73.34 110.388 177.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 -93.0 101.14 13.48 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.482 0.713 . . . . 72.02 109.082 176.434 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 41.6 m -91.58 117.78 30.03 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.123 0.569 . . . . 61.44 109.77 178.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.2 p80 -149.5 136.58 19.75 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.662 0.785 . . . . 75.0 109.786 -174.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.7 ttt -147.12 124.28 11.47 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.702 0.801 . . . . 70.1 109.739 -178.346 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -137.32 142.13 41.86 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.05 0.94 . . . . 51.42 108.472 175.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 57.2 m -145.32 133.24 21.27 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.294 0.638 . . . . 65.12 109.815 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.8 tp-100 -147.46 116.85 6.98 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 123.966 0.906 . . . . 63.44 108.655 178.509 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -131.17 132.5 44.78 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.682 0.793 . . . . 75.3 109.044 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -157.1 156.18 32.33 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.158 0.583 . . . . 70.25 109.936 -179.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.3 mm -69.31 107.77 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 109.161 -0.681 . . . . 75.12 109.161 175.193 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 59.2 m80 -74.04 116.01 14.18 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.484 1.114 . . . . 60.32 110.196 -177.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.8 mm -122.98 114.46 42.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.827 0 N-CA-C 107.697 -1.223 . . . . 62.1 107.697 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 40.7 ttmt -98.94 131.35 45.07 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.473 0.709 . . . . 71.21 109.992 -177.2 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.7 m -93.55 114.01 26.26 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.969 -0.752 . . . . 74.45 108.969 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.3 mt -121.14 137.61 54.59 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.859 0.864 . . . . 72.02 110.141 -175.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.2 p -85.73 153.83 22.05 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.876 0.87 . . . . 54.41 111.09 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.418 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 47.7 p -121.51 175.67 2.35 Favored Pre-proline 0 CA--C 1.56 1.35 0 N-CA-C 107.715 -1.217 . . . . 75.21 107.715 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.418 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 62.6 Cg_endo -71.76 2.76 4.36 Favored 'Trans proline' 0 C--N 1.377 2.057 0 C-N-CA 121.886 1.724 . . . . 72.54 113.061 167.42 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.562 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 91.2 m-20 -108.3 135.7 49.17 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.212 1.005 . . . . 75.11 111.501 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -72.02 -25.37 61.79 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.207 1.003 . . . . 73.43 111.623 174.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 87' ' ' ASN . 86.7 m-20 -112.02 29.94 7.46 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.021 0.928 . . . . 52.4 110.553 -176.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.562 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -142.01 124.73 15.95 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.177 0.591 . . . . 40.4 109.634 172.341 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.1 tp -135.02 121.43 20.42 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 108.609 -0.885 . . . . 74.52 108.609 178.488 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.532 ' HE2' HD13 ' A' ' 33' ' ' LEU . 87.8 tttt -87.61 119.43 27.91 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.181 0.992 . . . . 71.12 111.116 -175.155 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -103.8 111.21 23.63 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 107.818 -1.178 . . . . 71.41 107.818 173.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.532 HD13 ' HE2' ' A' ' 31' ' ' LYS . 37.8 tp -104.35 128.16 52.13 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 124.382 1.073 . . . . 61.21 110.185 -167.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 28.4 m -70.76 105.69 3.29 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.753 -1.202 . . . . 73.4 107.753 170.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.0 m -86.87 -15.53 38.78 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.858 0.463 . . . . 52.34 111.754 -168.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.58 -64.3 1.1 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.531 0.733 . . . . 75.33 111.201 -178.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.418 ' O ' ' HG3' ' A' ' 39' ' ' MET . . . 156.08 -7.4 0.25 Allowed Glycine 0 C--N 1.341 0.847 0 CA-C-O 119.392 -0.671 . . . . 74.33 113.302 -174.281 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 109' ' ' LEU . 1.0 OUTLIER -71.07 104.72 3.11 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 108.158 -1.053 . . . . 73.31 108.158 168.638 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.418 ' HG3' ' O ' ' A' ' 37' ' ' GLY . 87.9 mtp -103.3 151.04 23.17 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.652 0.781 . . . . 74.42 110.605 -170.277 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.7 mt -71.4 -36.4 71.37 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.885 0.874 . . . . 63.23 112.008 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 14.1 mm100 -129.64 -156.06 0.73 Allowed 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.515 0.726 . . . . 74.11 109.644 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.2 p -67.32 -146.76 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 124.052 0.941 . . . . 62.55 110.546 170.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -114.97 141.43 47.99 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 121.005 -1.06 . . . . 73.43 109.854 173.514 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 63.39 46.92 91.59 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 123.907 0.754 . . . . 64.33 112.5 -176.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 41.4 t -73.85 151.4 40.51 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.347 0.659 . . . . 72.4 111.0 -176.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -70.35 158.25 36.28 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 115.16 -0.927 . . . . 71.31 110.52 173.763 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.3 m -78.67 89.15 4.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.372 0.669 . . . . 70.22 109.431 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.635 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 42.8 mt -77.21 100.42 2.71 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 108.852 -0.795 . . . . 71.33 108.852 -177.358 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.1 t -90.33 109.8 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.549 0.74 . . . . 64.33 109.267 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 81.4 mt -118.73 111.06 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.39 1.076 . . . . 63.54 108.575 -178.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.525 ' HG2' ' HB3' ' A' ' 76' ' ' SER . 94.9 mttt -88.03 159.36 18.3 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 109.666 -0.494 . . . . 74.01 109.666 176.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -64.83 -20.93 66.66 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.918 0.487 . . . . 73.53 110.934 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 22.9 p -78.61 -31.23 46.96 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.124 0.97 . . . . 70.2 110.985 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -76.48 74.31 3.22 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.584 0.754 . . . . 51.3 110.128 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -55.88 -43.53 77.26 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.926 0.89 . . . . 64.34 111.742 -175.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -55.59 -48.31 75.05 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.09 0.956 . . . . 74.43 110.907 -177.484 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.3 mt -62.39 -36.05 81.09 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.102 -0.954 . . . . 71.14 111.052 -178.437 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 54.0 mt -73.51 -45.27 52.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 123.183 0.593 . . . . 52.41 110.311 -177.855 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -54.12 -30.87 50.49 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.422 1.089 . . . . 73.5 111.791 -178.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 64.1 m80 -87.81 -44.66 10.95 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.666 0.787 . . . . 71.13 110.703 175.833 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.662 ' HA ' ' HA ' ' A' ' 116' ' ' ILE . 50.5 m -79.04 98.76 6.6 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.056 0.455 . . . . 73.4 111.376 -176.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.503 ' HB2' ' HD2' ' A' ' 118' ' ' LYS . 31.6 ttpt -46.55 -53.08 12.07 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.716 1.607 . . . . 73.42 113.63 178.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.451 ' HB3' HG23 ' A' ' 115' ' ' VAL . 30.5 tp -65.3 -34.85 79.31 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.976 0.51 . . . . 75.35 111.722 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.15 -40.95 97.7 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 122.329 0.252 . . . . 74.41 110.527 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -56.07 -50.34 71.27 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.013 0.821 . . . . 75.42 110.305 176.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -60.83 -48.81 80.09 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.059 0.943 . . . . 74.01 113.127 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.3 -51.16 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 C-N-CA 123.403 0.681 . . . . 53.12 111.293 -175.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -67.23 -33.63 75.75 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.046 0.538 . . . . 74.15 111.193 -179.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.6 tp -59.81 -53.69 54.93 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.499 0.72 . . . . 74.04 110.794 176.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.504 ' NE2' HD21 ' A' ' 104' ' ' LEU . 74.1 mt-30 -77.45 -24.55 50.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 114.978 -1.01 . . . . 74.32 112.498 -175.044 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.564 ' SG ' HG23 ' A' ' 97' ' ' ILE . 72.7 m -144.84 96.91 4.99 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 109.35 -0.611 . . . . 72.11 109.35 -178.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.4 0.27 10.08 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 122.827 2.352 . . . . 73.12 113.132 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -84.68 -0.54 89.22 Favored Glycine 0 C--N 1.353 1.503 0 CA-C-O 119.89 -0.394 . . . . 74.23 113.023 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.0 t -82.22 123.76 38.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.237 0.615 . . . . 52.54 109.599 176.244 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -77.79 -55.0 5.69 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.932 0.893 . . . . 75.41 110.601 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.525 ' HB3' ' HG2' ' A' ' 51' ' ' LYS . 27.7 p -150.14 164.03 36.67 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.577 0.703 . . . . 74.41 111.459 -175.003 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 78.6 mt -122.57 128.66 51.02 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.427 1.091 . . . . 73.42 108.265 178.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.538 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.4 ttm -102.25 99.12 9.19 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 106.741 -1.577 . . . . 75.41 106.741 169.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.635 ' HB ' ' HB ' ' A' ' 48' ' ' ILE . 29.1 mm -80.87 125.22 39.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.24 -1.022 . . . . 72.3 108.24 -177.836 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.52 -173.18 20.8 Favored Glycine 0 C--O 1.242 0.6 0 N-CA-C 111.539 -0.625 . . . . 73.31 111.539 172.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -80.06 -58.18 3.28 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 122.807 0.443 . . . . 71.24 110.453 176.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -113.79 18.51 17.35 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 122.877 0.471 . . . . 71.41 110.92 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -148.5 163.61 36.66 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 122.755 0.422 . . . . 73.14 110.944 -177.232 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 51.8 tp -144.94 107.05 4.32 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.472 0.709 . . . . 74.22 109.243 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.538 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 28.0 m -96.95 106.74 19.13 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.299 -1.0 . . . . 75.13 108.299 -179.097 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.653 HG13 HD13 ' A' ' 101' ' ' ILE . 21.8 mm -87.47 141.53 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.518 0.727 . . . . 51.14 109.291 -175.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.455 ' HA ' ' O ' ' A' ' 28' ' ' ASN . 24.2 m-80 -120.82 120.63 36.13 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.802 0.841 . . . . 74.51 109.06 176.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.409 ' HD3' ' HB ' ' A' ' 92' ' ' VAL . 0.1 OUTLIER -122.01 165.94 15.25 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.719 0.808 . . . . 70.54 110.191 179.353 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -68.0 141.45 56.24 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.696 0.798 . . . . 62.3 109.382 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ARG . . . . . 0.444 ' HB3' HD21 ' A' ' 28' ' ' ASN . 2.2 ptm180 -68.63 -10.98 59.43 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 112.855 0.687 . . . . 73.53 112.855 -171.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.3 ptp -77.95 -16.13 58.42 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.011 0.525 . . . . 71.35 111.133 174.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.542 HG11 HD11 ' A' ' 97' ' ' ILE . 34.4 t -93.54 141.98 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.148 0.979 . . . . 75.25 110.262 -176.697 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 -95.17 136.23 35.77 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.922 0.889 . . . . 65.25 108.881 176.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 44.9 m95 -58.66 -43.55 89.89 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.611 0.967 . . . . 74.51 113.611 -174.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.8 t30 -57.82 -18.58 22.96 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.469 0.707 . . . . 63.14 112.717 -174.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.4 m -69.21 -54.27 15.63 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 121.386 0.613 . . . . 73.1 110.628 174.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.564 HG23 ' SG ' ' A' ' 71' ' ' CYS . 16.4 mt -83.96 -32.97 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 123.913 0.885 . . . . 75.3 110.858 -171.75 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -50.35 -56.08 20.95 Favored Pre-proline 0 CA--C 1.567 1.611 0 C-N-CA 125.038 1.335 . . . . 72.41 114.219 -172.134 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.58 -27.59 38.82 Favored 'Trans proline' 0 C--N 1.393 2.869 0 C-N-CA 121.8 1.666 . . . . 53.23 111.961 -176.305 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -67.78 -43.38 79.92 Favored 'General case' 0 C--N 1.349 0.568 0 C-N-CA 123.517 0.727 . . . . 71.33 109.746 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.653 HD13 HG13 ' A' ' 86' ' ' ILE . 95.6 mt -60.01 -51.16 76.15 Favored 'Isoleucine or valine' 0 C--N 1.359 0.998 0 C-N-CA 123.865 0.866 . . . . 71.02 109.784 176.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 74.0 mt -56.47 -41.04 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.522 0.729 . . . . 74.33 110.797 -178.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.75 -46.8 77.47 Favored 'General case' 0 CA--C 1.549 0.939 0 O-C-N 123.694 0.621 . . . . 55.11 110.933 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.504 HD21 ' NE2' ' A' ' 70' ' ' GLN . 99.0 mt -63.97 -35.07 79.48 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.958 0.903 . . . . 71.42 111.852 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 101' ' ' ILE . 8.6 mp -72.93 -23.72 60.72 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.83 0.852 . . . . 61.24 110.793 177.118 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 64.3 m -77.41 -36.59 53.17 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 109.183 -0.673 . . . . 75.02 109.183 174.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -66.42 -39.29 88.88 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.341 0.656 . . . . 73.01 110.296 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.409 HE22 ' HE3' ' A' ' 62' ' ' LYS . 11.7 mm100 -60.19 -63.68 1.22 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.561 0.745 . . . . 73.45 110.714 176.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 38' ' ' GLU . 74.2 mt -78.55 -2.83 40.7 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 114.854 -1.066 . . . . 74.23 112.377 -167.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -89.71 -49.03 6.88 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.531 0.732 . . . . 73.35 111.266 171.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -88.88 -52.35 5.15 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 116.129 -0.487 . . . . 72.14 110.78 -171.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -158.67 103.57 0.23 Allowed Glycine 0 C--N 1.342 0.884 0 N-CA-C 109.867 -1.293 . . . . 61.33 109.867 -175.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.99 -24.95 64.87 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.908 1.283 . . . . 72.51 112.778 -164.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -68.05 118.28 11.01 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 123.688 0.618 . . . . 73.34 109.96 -176.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.712 HG13 HG13 ' A' ' 116' ' ' ILE . 3.5 p -55.85 -42.71 71.68 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 125.625 1.57 . . . . 75.41 112.74 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.712 HG13 HG13 ' A' ' 115' ' ' VAL . 67.5 mt -92.94 -59.54 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.528 0.731 . . . . 53.02 109.839 -173.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.0 m -76.43 142.94 40.89 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 121.72 0.771 . . . . 42.44 112.543 -171.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.503 ' HD2' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -142.3 37.18 1.53 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.443 1.497 . . . . 72.2 107.961 176.124 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 . . . . . 0 CA--C 1.555 1.155 0 CA-C-N 114.202 -1.363 . . . . 75.34 109.872 -177.677 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.455 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 mpt? . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 108.748 -0.834 . . . . 73.24 108.748 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.62 142.04 39.7 Favored Glycine 0 C--N 1.35 1.322 0 O-C-N 123.858 0.723 . . . . 52.4 113.719 -176.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -125.96 134.89 51.38 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.874 0.87 . . . . 75.33 109.5 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -150.08 145.68 26.5 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.081 0.953 . . . . 73.33 109.374 178.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -132.12 152.9 50.98 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.455 0.702 . . . . 63.4 109.243 -177.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -84.98 126.63 33.69 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 110.158 -0.312 . . . . 71.03 110.158 176.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -75.36 123.89 26.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.71 0.804 . . . . 73.32 109.923 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -88.88 118.09 28.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.98 0.912 . . . . 55.32 109.88 176.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 43.0 m -94.78 156.81 16.22 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.481 0.712 . . . . 65.3 110.272 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.7 t-80 -66.18 97.7 0.4 Allowed 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.173 -0.677 . . . . 71.2 109.173 173.177 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 88.2 mtp -80.71 99.8 8.39 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 108.574 -0.899 . . . . 71.15 108.574 177.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -77.53 145.91 36.67 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.423 0.689 . . . . 73.34 111.229 -171.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.9 t -99.61 90.94 4.66 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 107.859 -1.163 . . . . 54.22 107.859 174.684 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -65.59 91.99 0.14 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.282 0.563 . . . . 74.14 110.322 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -133.21 70.71 1.46 Allowed 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.204 1.002 . . . . 74.5 108.798 177.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -151.15 149.04 29.0 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 123.806 0.842 . . . . 53.32 109.099 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.421 ' HB ' HG23 ' A' ' 106' ' ' THR . 77.0 mt -83.24 96.1 3.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.067 -1.086 . . . . 65.41 108.067 173.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.469 ' HB3' ' HB3' ' A' ' 36' ' ' ASP . 62.7 t60 -69.23 122.14 18.23 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 113.829 -1.532 . . . . 72.35 111.707 -170.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 47.9 mm -126.34 125.55 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 107.239 -1.393 . . . . 70.11 107.239 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.416 ' HE2' HD23 ' A' ' 33' ' ' LEU . 38.8 ttpt -99.13 126.13 44.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.069 0.548 . . . . 65.4 109.541 -178.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 35.0 m -92.0 117.21 29.6 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.276 0.63 . . . . 73.43 109.382 -177.092 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.6 mt -115.11 138.47 50.86 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.179 0.991 . . . . 52.45 109.407 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 54.9 p -85.13 153.27 22.79 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.297 0.639 . . . . 71.31 110.568 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.402 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 71.7 p -119.52 172.73 4.14 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 124.291 1.037 . . . . 75.34 109.064 -174.444 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.402 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 86.4 Cg_endo -75.17 14.86 0.83 Allowed 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 122.185 1.923 . . . . 73.55 113.215 167.764 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.422 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 11.1 m120 -118.95 157.16 28.26 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 124.167 0.987 . . . . 51.14 109.361 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.76 -32.93 10.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.276 0.631 . . . . 62.13 109.931 175.096 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -71.6 -40.63 69.71 Favored 'General case' 0 C--O 1.215 -0.759 0 C-N-CA 123.0 0.52 . . . . 73.5 110.153 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.422 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -93.09 141.22 28.66 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.075 0.55 . . . . 62.35 111.487 -175.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.8 tp -140.49 133.2 28.9 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 108.455 -0.943 . . . . 65.3 108.455 172.743 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -93.25 131.52 38.29 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.824 0.85 . . . . 65.41 110.672 -173.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -120.17 121.02 37.84 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.826 1.25 . . . . 75.11 107.996 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.416 HD23 ' HE2' ' A' ' 20' ' ' LYS . 47.3 tp -106.77 128.8 54.54 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.567 0.747 . . . . 71.42 110.488 -171.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.2 m -73.91 106.09 5.46 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.319 -0.993 . . . . 64.22 108.319 171.134 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.4 m -105.85 -32.19 8.48 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.024 0.53 . . . . 63.24 111.797 -163.61 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.469 ' HB3' ' HB3' ' A' ' 18' ' ' HIS . 5.8 p-10 -82.55 -162.55 0.59 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.273 0.229 . . . . 53.11 110.593 178.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.69 -16.67 63.8 Favored Glycine 0 C--N 1.355 1.589 0 N-CA-C 114.323 0.489 . . . . 51.24 114.323 -177.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -86.21 147.31 26.17 Favored 'General case' 0 C--N 1.352 0.688 0 CA-C-N 117.82 0.81 . . . . 54.23 110.266 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 25.4 ttt -147.05 130.64 16.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 107.638 -1.245 . . . . 70.12 107.638 -173.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.424 ' O ' ' HA ' ' A' ' 114' ' ' ASP . 64.1 mt -54.15 -45.94 72.14 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.87 0.868 . . . . 23.23 112.176 -171.126 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.558 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 5.4 tt0 -145.37 152.68 40.25 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.117 1.367 . . . . 65.33 108.757 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.2 m -73.96 150.08 40.97 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 123.437 0.695 . . . . 72.43 109.772 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.4 mmm180 -57.5 97.02 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.825 0.85 . . . . 75.22 109.719 174.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -154.48 -47.94 0.01 OUTLIER Glycine 0 N--CA 1.466 0.698 0 CA-C-N 115.868 -0.606 . . . . 33.4 111.773 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 29.2 t -110.4 177.41 4.7 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.345 0.658 . . . . 70.04 110.839 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -97.36 -174.37 2.91 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.845 1.258 . . . . 74.34 110.925 -174.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' SER . . . . . 0.4 ' HA ' ' O ' ' A' ' 79' ' ' ILE . 28.0 p -76.82 88.02 3.42 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.235 0.614 . . . . 73.14 110.1 175.189 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.618 HD12 HD13 ' A' ' 116' ' ' ILE . 54.7 mt -76.8 127.61 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.803 0.841 . . . . 74.24 110.828 -177.189 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 95.6 t -89.79 123.81 42.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 N-CA-C 109.127 -0.694 . . . . 62.13 109.127 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.433 HG12 ' HB3' ' A' ' 57' ' ' LEU . 54.5 mt -116.02 110.11 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 108.283 -1.006 . . . . 62.04 108.283 174.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -90.87 164.79 13.92 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 109.203 -0.666 . . . . 74.12 109.203 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -57.44 -27.35 62.36 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 124.168 0.918 . . . . 74.04 112.292 175.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.5 p -75.31 -33.76 61.2 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.64 0.776 . . . . 73.51 111.86 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.414 ' O ' HG13 ' A' ' 58' ' ' ILE . 3.9 m-20 -78.86 74.23 5.39 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.431 0.692 . . . . 53.35 111.164 -170.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -50.49 -42.38 54.6 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.977 1.311 . . . . 73.04 111.565 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -58.37 -49.25 77.91 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.752 0.821 . . . . 74.34 111.476 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.433 ' HB3' HG12 ' A' ' 50' ' ' ILE . 80.4 mt -70.49 -38.82 74.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.538 0.735 . . . . 63.43 111.362 -175.596 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 54' ' ' ASP . 81.4 mt -57.76 -48.13 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.02 0.928 . . . . 75.44 109.443 175.078 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -66.64 -26.05 66.88 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.355 0.872 . . . . 62.31 113.355 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -70.52 -36.57 73.83 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.536 0.334 . . . . 73.24 111.383 178.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.41 ' HB3' HG23 ' A' ' 116' ' ' ILE . 38.5 p -116.62 105.72 12.75 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.518 0.727 . . . . 72.42 109.552 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -62.77 -19.94 64.48 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.993 0.517 . . . . 71.33 111.427 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.575 HD11 HD12 ' A' ' 105' ' ' LEU . 48.7 tp -60.04 -46.98 87.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.366 0.666 . . . . 71.52 110.1 170.466 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.13 -41.81 99.38 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.242 0.617 . . . . 64.23 110.745 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -56.4 -48.6 76.59 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 123.861 0.726 . . . . 74.32 110.883 175.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -60.51 -44.56 95.88 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.86 0.864 . . . . 63.32 112.79 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.517 HG22 HG21 ' A' ' 74' ' ' VAL . 97.1 mt -66.54 -46.41 86.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 123.35 0.66 . . . . 75.1 110.605 -177.215 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -68.95 -37.07 78.63 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.799 0.44 . . . . 75.34 111.779 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.2 tp -66.82 -53.83 28.73 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.526 0.73 . . . . 73.3 110.604 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -81.0 -24.05 38.25 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 114.941 -1.027 . . . . 70.14 111.666 -173.231 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 38.2 m -126.37 97.15 34.72 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 109.487 -0.56 . . . . 75.03 109.487 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.11 -17.34 45.59 Favored 'Trans proline' 0 C--N 1.378 2.093 0 C-N-CA 123.59 2.86 . . . . 64.25 113.879 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -89.96 13.59 64.21 Favored Glycine 0 C--N 1.346 1.11 0 CA-C-O 119.69 -0.505 . . . . 53.24 113.576 -177.246 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.517 HG21 HG22 ' A' ' 67' ' ' ILE . 41.6 t -85.69 122.4 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.732 -0.84 . . . . 72.02 108.732 173.623 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -90.06 -40.49 12.26 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.509 0.724 . . . . 74.03 110.085 -177.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.9 p -160.1 170.85 20.38 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.486 -0.779 . . . . 51.03 110.832 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 85.4 mt -131.61 150.52 52.12 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.045 1.338 . . . . 72.04 108.516 177.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.414 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 57.6 ttm -123.85 102.56 7.86 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 107.255 -1.387 . . . . 75.22 107.255 167.993 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 47' ' ' SER . 15.3 mm -82.5 120.45 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 115.552 -0.749 . . . . 73.54 109.176 -177.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.06 -179.7 21.28 Favored Glycine 0 C--O 1.242 0.642 0 N-CA-C 111.41 -0.676 . . . . 64.34 111.41 172.558 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.558 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 4.5 p-10 -72.33 -53.8 11.32 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.294 0.638 . . . . 53.14 110.774 178.363 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 0.4 ' O ' HD12 ' A' ' 33' ' ' LEU . 14.0 p-10 -116.58 -0.3 12.47 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.755 -0.591 . . . . 72.42 111.435 177.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -126.52 156.24 41.09 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.754 -0.462 . . . . 72.31 109.754 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.549 HD23 HD11 ' A' ' 105' ' ' LEU . 39.5 tp -144.84 119.69 9.92 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.216 -0.661 . . . . 72.1 109.216 176.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 32.9 m -107.59 108.35 19.59 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 109.415 -0.587 . . . . 75.3 109.415 -177.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.511 ' HB ' ' HH2' ' A' ' 94' ' ' TRP . 21.1 mm -89.66 141.48 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 N-CA-C 108.259 -1.015 . . . . 74.34 108.259 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -114.31 119.67 37.76 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.601 -0.518 . . . . 75.01 109.601 179.047 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.676 ' HZ2' HD13 ' A' ' 97' ' ' ILE . 5.0 mptp? -105.45 159.31 16.03 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.684 1.194 . . . . 64.3 110.734 177.081 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.4 ' HB3' HG23 ' A' ' 92' ' ' VAL . 13.5 t70 -69.49 145.46 52.69 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 114.187 -1.369 . . . . 73.41 109.254 172.706 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -25.69 68.42 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 123.886 0.874 . . . . 75.2 113.093 -176.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 65.6 mtm -87.58 -9.01 55.55 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.672 0.789 . . . . 74.54 111.276 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.4 HG23 ' HB3' ' A' ' 89' ' ' ASP . 39.8 t -102.53 135.98 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 109.528 -0.545 . . . . 71.44 109.528 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -79.64 138.17 37.32 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.233 1.013 . . . . 61.01 111.387 -172.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.511 ' HH2' ' HB ' ' A' ' 86' ' ' ILE . 6.0 m95 -80.38 -52.8 7.25 Favored 'General case' 0 N--CA 1.483 1.217 0 N-CA-C 113.277 0.844 . . . . 73.22 113.277 -174.794 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.87 -18.16 54.52 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.782 0.833 . . . . 63.41 112.843 -174.664 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.1 t -74.67 -40.77 61.21 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.168 0.987 . . . . 64.52 110.267 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.676 HD13 ' HZ2' ' A' ' 88' ' ' LYS . 16.2 mt -94.12 -15.54 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 CA-C-N 115.162 -0.926 . . . . 73.41 112.552 -168.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -49.63 -47.89 77.64 Favored Pre-proline 0 N--CA 1.491 1.579 0 CA-C-O 118.193 -0.908 . . . . 71.33 113.114 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -56.36 -39.12 93.39 Favored 'Trans proline' 0 C--N 1.396 3.073 0 C-N-CA 122.012 1.808 . . . . 60.03 113.126 176.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.461 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 8.3 mm-40 -63.61 -50.95 67.36 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.344 0.658 . . . . 74.11 110.403 -178.674 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.44 ' O ' HD13 ' A' ' 105' ' ' LEU . 76.4 mt -61.17 -54.84 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.017 -0.992 . . . . 74.24 110.489 -177.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 89.1 mt -55.37 -38.28 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 123.511 0.724 . . . . 74.23 110.96 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -66.17 -43.69 86.19 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.493 0.717 . . . . 73.54 111.112 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 88.9 mt -64.35 -38.57 91.52 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.463 0.705 . . . . 74.23 111.194 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.575 HD12 HD11 ' A' ' 63' ' ' LEU . 10.0 mp -63.52 -34.45 77.81 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.645 0.778 . . . . 75.23 110.277 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.421 HG23 ' HB ' ' A' ' 17' ' ' ILE . 93.1 m -72.96 -31.32 64.48 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.302 0.641 . . . . 74.0 110.102 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -63.86 -54.42 35.22 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.9 0.48 . . . . 61.22 110.35 176.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -58.27 -45.05 88.58 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 123.824 0.703 . . . . 73.44 111.541 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.402 HD21 ' HA ' ' A' ' 40' ' ' LEU . 95.8 mt -75.93 -17.83 59.6 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.091 -0.959 . . . . 50.23 111.434 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.34 -28.8 59.75 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.143 0.577 . . . . 63.22 110.418 172.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -72.31 -27.09 62.23 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.148 -0.478 . . . . 65.12 109.921 168.71 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.67 30.38 64.12 Favored Glycine 0 C--N 1.353 1.516 0 CA-C-N 115.513 -0.767 . . . . 65.33 111.213 -172.623 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -92.91 139.96 29.98 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.441 1.096 . . . . 74.34 111.151 -171.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.424 ' HA ' ' O ' ' A' ' 40' ' ' LEU . 5.8 m-20 -76.65 119.11 20.01 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.474 -0.936 . . . . 74.52 108.474 169.331 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 2.7 p -49.15 -50.03 15.74 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 C-N-CA 125.636 1.574 . . . . 53.53 112.385 -176.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.618 HD13 HD12 ' A' ' 48' ' ' ILE . 1.7 pp -160.03 162.67 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 125.854 1.662 . . . . 72.24 107.588 173.098 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 55.6 m -104.43 -87.69 0.44 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 107.019 -1.474 . . . . 64.11 107.019 165.042 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -122.73 -34.74 3.17 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.085 0.554 . . . . 72.35 111.246 -174.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 . . . . . 0 C--O 1.254 1.325 0 N-CA-C 109.191 -0.67 . . . . 70.54 109.191 -178.248 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.486 1.368 0 N-CA-C 109.737 -0.468 . . . . 62.43 109.737 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -115.04 23.82 11.22 Favored Glycine 0 C--N 1.351 1.377 0 CA-C-N 115.981 -0.554 . . . . 51.32 112.368 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -75.8 87.31 2.81 Favored 'General case' 0 C--N 1.353 0.718 0 N-CA-C 108.246 -1.02 . . . . 65.41 108.246 174.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 70.5 t60 -73.0 107.03 5.13 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.904 -0.776 . . . . 72.43 108.904 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -76.62 124.87 28.28 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 124.155 0.91 . . . . 73.45 110.664 -175.004 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 25.7 p-80 -142.25 70.08 1.33 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 122.112 0.958 . . . . 74.41 109.384 177.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 66.1 t60 -112.36 102.84 10.96 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 114.916 -1.038 . . . . 75.42 109.777 -177.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -158.79 44.14 0.27 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.713 0.805 . . . . 74.04 109.997 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.4 m -117.04 98.39 6.44 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 109.533 -0.543 . . . . 74.22 109.533 174.6 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -167.09 139.87 3.5 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.244 1.017 . . . . 74.35 109.281 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 55.7 tpp -134.41 95.26 3.35 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.467 -0.938 . . . . 70.05 108.467 174.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -73.99 -20.93 60.18 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.387 -0.824 . . . . 62.51 111.123 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.7 m -79.32 33.9 0.24 Allowed 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 124.377 1.071 . . . . 73.33 112.554 -177.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -93.91 27.77 2.65 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 121.679 -0.638 . . . . 74.14 111.724 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -82.48 173.96 11.52 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.814 0.846 . . . . 53.21 109.955 172.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -132.0 128.27 38.02 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 108.133 -1.062 . . . . 71.32 108.133 172.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.8 mt -78.22 117.51 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.111 0.564 . . . . 73.11 109.808 -176.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -72.31 122.24 20.81 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.421 -0.809 . . . . 73.33 109.564 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.8 mm -115.55 122.22 68.91 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 105.599 -2.0 . . . . 51.54 105.599 177.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -91.01 120.59 32.13 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.308 -0.997 . . . . 74.25 108.308 -172.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.7 m -93.25 113.29 25.46 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.522 -0.918 . . . . 63.52 108.522 -176.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.9 mt -105.83 138.14 42.53 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.601 0.76 . . . . 44.53 109.388 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.0 p -73.71 142.63 46.34 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.708 0.803 . . . . 71.42 110.695 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 p -113.09 168.0 8.4 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 124.681 1.192 . . . . 71.03 109.827 -174.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -67.73 -10.87 30.21 Favored 'Trans proline' 0 C--N 1.383 2.388 0 C-N-CA 122.693 2.262 . . . . 71.42 113.459 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -125.12 134.52 52.42 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.456 0.702 . . . . 71.44 109.761 -178.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -73.2 -24.85 60.57 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.279 0.632 . . . . 53.12 110.973 173.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -66.08 -20.75 66.26 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.115 0.966 . . . . 60.21 111.218 176.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.1 162.56 22.22 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.24 1.016 . . . . 74.41 110.107 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.4 tp -160.66 131.24 5.36 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 109.571 -0.529 . . . . 71.14 109.571 173.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -85.44 117.11 24.16 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.281 1.032 . . . . 72.53 110.85 -174.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -107.77 110.8 22.7 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.399 1.079 . . . . 73.44 108.216 173.29 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.6 tp -102.84 123.61 46.81 Favored 'General case' 0 C--O 1.243 0.744 0 N-CA-C 108.674 -0.861 . . . . 55.13 108.674 -169.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.1 p -80.87 106.21 12.7 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 107.828 -1.175 . . . . 71.44 107.828 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.2 p -109.89 -58.52 2.05 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.765 0.826 . . . . 74.43 110.181 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -69.72 110.29 4.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.135 0.974 . . . . 63.13 111.607 -172.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.08 -85.23 1.01 Allowed Glycine 0 C--N 1.342 0.911 0 O-C-N 124.107 0.879 . . . . 63.1 112.989 174.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.8 mp0 -95.62 164.14 12.9 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.9 0.88 . . . . 62.44 111.993 -170.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.3 ttt -125.58 147.28 49.34 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.077 1.751 . . . . 63.2 107.554 -177.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.7 mt -67.35 -51.97 45.84 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.085 0.772 . . . . 61.33 113.085 -169.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.62 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 43.9 tt0 -141.78 163.43 32.92 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.239 0.616 . . . . 70.1 109.55 -172.148 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.6 m -70.08 134.87 48.66 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.617 0.767 . . . . 74.41 110.256 174.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -71.24 155.36 40.8 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.989 0.516 . . . . 74.34 110.151 174.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 89.92 47.03 4.03 Favored Glycine 0 C--N 1.345 1.054 0 N-CA-C 109.829 -1.308 . . . . 75.31 109.829 -172.199 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.5 p -148.54 173.16 13.43 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.105 0.962 . . . . 73.41 110.04 -172.125 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -98.26 162.49 13.16 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.635 0.774 . . . . 75.14 110.067 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 p -82.82 99.5 9.74 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.615 0.766 . . . . 70.34 109.774 176.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.0 mt -76.87 107.73 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 123.142 0.577 . . . . 73.4 110.377 -173.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 76.8 t -87.55 105.34 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 108.046 -1.094 . . . . 74.24 108.046 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 75.2 mt -94.83 109.09 21.73 Favored 'Isoleucine or valine' 0 C--N 1.337 0.062 0 N-CA-C 107.999 -1.112 . . . . 75.13 107.999 -178.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -87.64 142.22 28.01 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.679 0.792 . . . . 72.42 109.77 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.505 ' HA ' HD11 ' A' ' 58' ' ' ILE . 36.9 p30 -67.43 -22.45 65.51 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.245 0.618 . . . . 74.35 111.574 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.2 t -87.85 -4.79 58.83 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.95 0.9 . . . . 71.42 112.043 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -108.11 103.7 12.97 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.102 0.561 . . . . 62.34 110.186 -175.24 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -45.44 -61.97 1.46 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 124.932 1.293 . . . . 55.3 113.605 176.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -69.65 -30.95 68.76 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.758 0.651 . . . . 53.31 112.758 -166.062 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.17 -36.17 83.18 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 123.397 0.436 . . . . 73.32 111.666 175.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.505 HD11 ' HA ' ' A' ' 52' ' ' ASN . 39.6 mt -84.22 -38.17 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 123.309 0.644 . . . . 62.13 110.381 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -56.19 -39.85 73.06 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 125.061 1.344 . . . . 64.4 112.15 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -85.98 -1.98 57.85 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.798 -0.637 . . . . 71.41 111.566 -176.685 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.525 ' HB3' HG12 ' A' ' 116' ' ' ILE . 34.0 p -127.78 101.38 6.33 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.208 0.603 . . . . 73.22 111.135 -172.828 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -57.65 -47.28 82.72 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.473 1.109 . . . . 74.32 112.287 -177.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.403 HD11 HD12 ' A' ' 105' ' ' LEU . 49.5 tp -63.93 -35.99 82.47 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 123.912 0.758 . . . . 74.31 111.409 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.39 -40.94 89.96 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.668 0.387 . . . . 72.11 111.189 178.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.419 ' HG2' HG22 ' A' ' 58' ' ' ILE . 23.9 mt-30 -58.79 -43.5 90.5 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 124.241 0.963 . . . . 72.55 110.242 176.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -58.66 -51.45 69.88 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.644 0.778 . . . . 75.14 112.519 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 83.3 mt -66.18 -44.54 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.434 0.694 . . . . 62.51 111.35 -173.563 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -71.13 -37.69 72.3 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 112.243 0.46 . . . . 72.0 112.243 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 42.9 tp -69.87 -45.92 66.65 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.865 0.466 . . . . 71.34 110.919 -177.466 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -81.08 -29.88 34.84 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.222 0.609 . . . . 74.53 111.691 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 63.9 m -133.28 88.11 36.5 Favored Pre-proline 0 CA--C 1.548 0.904 0 N-CA-C 109.057 -0.72 . . . . 73.42 109.057 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -77.02 -2.32 12.56 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 122.735 2.29 . . . . 72.1 112.758 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.04 3.4 71.13 Favored Glycine 0 C--N 1.356 1.659 0 CA-C-N 116.327 -0.397 . . . . 71.43 113.18 176.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.0 t -92.68 133.3 34.42 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.405 1.082 . . . . 74.41 109.974 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.458 ' H ' ' HA ' ' A' ' 88' ' ' LYS . 16.2 mm-40 -86.16 -49.95 7.36 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.381 1.072 . . . . 72.34 110.703 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.6 p -159.21 163.46 35.91 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.488 -0.778 . . . . 71.41 111.066 -175.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.4 mt -121.86 125.98 47.68 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 108.535 -0.913 . . . . 54.25 108.535 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.6 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.1 ttm -98.64 99.82 10.98 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 106.897 -1.519 . . . . 61.4 106.897 174.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.636 HD13 HD13 ' A' ' 84' ' ' LEU . 19.1 mm -85.41 110.67 19.78 Favored 'Isoleucine or valine' 0 C--O 1.242 0.662 0 N-CA-C 108.765 -0.828 . . . . 75.42 108.765 -172.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -101.25 173.68 24.38 Favored Glycine 0 C--O 1.247 0.931 0 N-CA-C 109.802 -1.319 . . . . 63.12 109.802 173.285 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.62 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 10.5 p-10 -74.93 -44.66 47.32 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 122.87 0.468 . . . . 64.33 110.022 175.461 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -86.81 -41.72 13.85 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.448 0.699 . . . . 70.23 111.468 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 36.4 p90 -131.2 171.62 13.08 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 121.247 0.546 . . . . 72.4 112.204 -164.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.636 HD13 HD13 ' A' ' 79' ' ' ILE . 14.1 tp -139.51 110.8 6.99 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.731 1.212 . . . . 63.53 107.915 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.6 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 66.7 m -95.42 108.18 20.37 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.088 -1.079 . . . . 70.55 108.088 -177.787 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.613 HG13 HD13 ' A' ' 101' ' ' ILE . 12.0 mm -87.01 102.9 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.501 0.72 . . . . 74.34 109.152 -173.456 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -84.2 128.08 34.34 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 107.33 -1.359 . . . . 72.33 107.33 175.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.458 ' HA ' ' H ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -148.93 168.1 23.98 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.603 0.761 . . . . 73.21 111.867 -171.28 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -71.42 122.79 21.01 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.197 1.399 . . . . 71.31 109.799 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -71.45 -12.5 61.43 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 113.147 0.795 . . . . 72.12 113.147 -170.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.7 mmm -78.06 -30.94 50.02 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.754 -0.461 . . . . 75.3 109.754 175.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.6 t -83.34 144.94 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 107.923 -1.14 . . . . 75.33 107.923 175.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -102.14 158.65 16.01 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.3 0.64 . . . . 72.4 111.636 -171.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -75.68 -24.73 56.31 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.977 0.911 . . . . 72.22 112.143 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -59.86 -27.32 66.58 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.423 0.689 . . . . 64.44 111.223 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.2 m -92.79 -35.55 13.35 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.954 0.902 . . . . 62.24 112.412 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.433 HG22 HD11 ' A' ' 101' ' ' ILE . 24.5 mt -93.28 -45.66 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 CA-C-N 117.861 0.301 . . . . 52.14 111.212 -170.226 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -53.5 -46.29 98.19 Favored Pre-proline 0 N--CA 1.492 1.674 0 N-CA-C 114.522 1.304 . . . . 72.4 114.522 -174.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -55.41 -39.59 90.2 Favored 'Trans proline' 0 C--N 1.392 2.866 0 C-N-CA 121.803 1.668 . . . . 62.12 112.168 175.37 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -68.22 -40.45 82.08 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.466 -0.788 . . . . 75.53 110.382 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.613 HD13 HG13 ' A' ' 86' ' ' ILE . 84.8 mt -62.48 -52.01 65.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.551 0.74 . . . . 72.12 110.364 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 79.4 mt -61.32 -37.54 77.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.369 0.668 . . . . 63.3 110.83 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.25 -47.69 72.92 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.431 0.692 . . . . 53.32 111.057 178.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 98.4 mt -68.44 -35.26 77.35 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.761 0.825 . . . . 62.53 111.99 -179.012 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.403 HD12 HD11 ' A' ' 63' ' ' LEU . 9.0 mp -69.34 -23.79 63.82 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.315 0.646 . . . . 71.3 110.492 175.084 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 53.8 m -78.9 -44.96 21.58 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.265 0.626 . . . . 72.23 109.993 173.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -57.46 -49.58 75.82 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.017 0.927 . . . . 64.31 110.483 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -50.57 -60.74 2.71 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.556 1.142 . . . . 74.52 111.366 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.4 mt -75.43 -19.11 59.68 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 115.682 -0.69 . . . . 74.54 112.058 -170.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.53 -46.72 14.07 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.599 0.76 . . . . 74.45 110.769 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -80.15 -15.02 57.99 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 115.92 -0.582 . . . . 64.34 111.208 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 84.45 19.27 60.63 Favored Glycine 0 C--N 1.35 1.316 0 CA-C-N 116.405 -0.361 . . . . 74.0 112.796 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.15 167.75 17.12 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.442 1.097 . . . . 71.35 111.148 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.36 139.4 34.18 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.323 1.049 . . . . 64.45 110.172 -174.548 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 4.1 p -66.88 -49.59 72.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 N-CA-C 108.868 -0.79 . . . . 70.11 108.868 165.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.569 HD11 HG13 ' A' ' 79' ' ' ILE . 71.0 mt -140.49 -59.67 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 106.224 -1.769 . . . . 52.54 106.224 177.38 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.2 p -157.23 134.91 10.72 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 113.747 -1.569 . . . . 54.32 108.189 171.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -87.67 41.2 0.97 Allowed 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.013 0.925 . . . . 64.42 109.875 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 . . . . . 0 C--O 1.253 1.268 0 N-CA-C 107.115 -1.439 . . . . 73.11 107.115 -172.637 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.2 mtp . . . . . 0 N--CA 1.482 1.17 0 N-CA-C 109.225 -0.657 . . . . 52.25 109.225 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 71.54 -145.76 39.35 Favored Glycine 0 C--N 1.35 1.317 0 O-C-N 123.68 0.613 . . . . 73.21 111.784 -176.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 64.77 5.66 2.92 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.577 1.151 . . . . 73.12 112.673 174.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 39.1 t-80 -77.97 112.78 15.22 Favored 'General case' 0 C--N 1.353 0.718 0 C-N-CA 122.881 0.472 . . . . 74.35 110.449 -173.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -127.53 -73.37 0.61 Allowed 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.516 -0.766 . . . . 74.54 109.159 174.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 49.23 44.8 23.44 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 121.625 0.726 . . . . 65.13 110.151 -168.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.2 t60 -64.31 95.64 0.14 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.139 -1.391 . . . . 62.33 110.607 -170.557 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -138.86 122.1 16.99 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.336 -0.847 . . . . 63.32 109.497 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -120.51 84.69 2.26 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.354 1.062 . . . . 74.2 108.248 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.9 t60 -158.67 129.29 6.1 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.858 0.863 . . . . 72.34 109.778 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -159.14 129.86 5.98 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 123.147 0.579 . . . . 75.53 110.111 172.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -124.38 87.7 2.77 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 107.985 -1.117 . . . . 62.13 107.985 171.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 41.6 m -137.05 76.37 1.58 Allowed 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.037 -0.983 . . . . 73.52 108.895 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -110.13 -53.48 2.67 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 114.924 -1.035 . . . . 64.24 110.042 -174.266 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -133.91 124.98 27.33 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.68 0.792 . . . . 72.55 110.245 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -148.35 119.19 7.58 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 108.238 -1.023 . . . . 74.14 108.238 169.856 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.0 mt -115.46 107.89 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 N-CA-C 109.136 -0.69 . . . . 75.32 109.136 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -64.15 118.54 8.72 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.848 1.259 . . . . 74.13 110.389 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 42.1 mm -122.37 113.42 38.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 N-CA-C 106.193 -1.78 . . . . 75.22 106.193 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -105.57 119.96 40.44 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 106.891 -1.522 . . . . 65.43 106.891 -175.449 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.503 HG21 ' HD2' ' A' ' 98' ' ' LYS . 12.3 t -109.58 111.81 23.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-O 121.834 0.826 . . . . 72.12 108.934 -171.458 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.0 mt -91.56 147.6 22.89 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.152 -0.931 . . . . 73.3 111.342 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.9 p -81.66 145.86 30.34 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.669 -1.15 . . . . 74.25 110.011 176.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 50.1 p -115.81 176.65 1.44 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 107.939 -1.134 . . . . 73.32 107.939 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -49.8 -30.35 22.89 Favored 'Trans proline' 0 C--N 1.384 2.41 0 C-N-CA 122.079 1.852 . . . . 45.32 113.4 165.548 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -86.19 146.26 26.63 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 109.083 -0.71 . . . . 73.03 109.083 174.627 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -88.76 -36.22 16.24 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.946 0.898 . . . . 71.23 110.838 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -91.49 -17.39 25.78 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.461 1.104 . . . . 53.42 111.982 -171.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -99.77 109.34 21.77 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.219 -1.03 . . . . 75.45 108.219 169.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.2 tp -114.96 126.77 55.16 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.696 -0.853 . . . . 52.4 108.696 -175.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -92.47 110.08 21.48 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.088 0.955 . . . . 75.34 110.294 -170.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -92.56 127.19 37.96 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.599 0.76 . . . . 74.23 109.642 -177.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.3 tp -117.65 137.94 52.31 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.565 0.746 . . . . 73.2 109.835 -179.156 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.0 t -89.99 121.27 31.93 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.314 -0.995 . . . . 65.12 108.314 170.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 34.3 p -99.6 0.62 42.53 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.455 0.539 . . . . 72.24 112.455 -176.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -103.53 33.11 3.49 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.022 0.529 . . . . 73.35 111.721 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.68 -44.99 3.29 Favored Glycine 0 C--N 1.347 1.151 0 CA-C-O 119.755 -0.47 . . . . 73.44 113.97 171.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.518 ' HB3' HD22 ' A' ' 109' ' ' LEU . 9.3 mm-40 -59.29 92.06 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.68 0.792 . . . . 64.34 112.764 -177.199 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 51.4 ttm -78.94 138.54 38.13 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 114.822 -1.081 . . . . 53.43 109.104 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.3 mt -63.86 -56.14 17.59 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.772 0.829 . . . . 62.45 111.279 -172.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -129.68 133.84 47.32 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.895 -1.15 . . . . 65.25 107.895 173.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.9 p -57.68 137.46 56.43 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.544 0.738 . . . . 75.55 111.605 -173.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -59.44 120.63 9.7 Favored 'General case' 0 CA--C 1.549 0.933 0 O-C-N 124.031 0.832 . . . . 75.2 111.544 -168.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 135.75 -6.86 4.17 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 114.864 -1.062 . . . . 73.25 111.017 -168.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.0 t -76.3 174.92 9.58 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.917 1.287 . . . . 60.01 111.27 178.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -112.79 158.13 20.49 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.585 1.154 . . . . 74.2 108.383 177.186 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.5 m -76.58 93.29 3.56 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.314 0.645 . . . . 74.45 110.038 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.442 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 56.1 mt -74.87 104.54 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.596 0.758 . . . . 72.23 110.246 -177.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.4 t -81.29 108.69 14.79 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 123.443 0.697 . . . . 73.2 109.165 -178.106 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.533 HD11 HD11 ' A' ' 116' ' ' ILE . 53.3 mt -106.06 108.36 24.88 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 N-CA-C 107.348 -1.353 . . . . 73.11 107.348 175.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -94.71 166.01 12.21 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 108.725 -0.842 . . . . 73.52 108.725 175.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.46 ' HA ' HD11 ' A' ' 58' ' ' ILE . 30.7 p30 -70.9 -8.9 56.19 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 120.65 0.262 . . . . 62.35 111.548 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.3 p -85.56 -25.31 26.82 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.494 0.718 . . . . 70.11 110.928 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -86.39 70.68 10.51 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.254 0.622 . . . . 74.41 109.495 177.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -56.65 -37.45 70.79 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.529 -0.759 . . . . 71.12 111.025 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -53.08 -44.83 67.86 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.614 1.166 . . . . 75.42 111.734 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.6 mt -73.39 -30.39 63.24 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 116.084 -0.507 . . . . 63.33 111.659 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.46 HD11 ' HA ' ' A' ' 52' ' ' ASN . 77.6 mt -70.17 -43.47 78.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 123.648 0.779 . . . . 65.2 110.66 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -54.08 -39.52 66.4 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.647 0.779 . . . . 61.12 112.703 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -99.08 28.84 4.17 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 120.88 0.371 . . . . 74.44 111.907 -177.542 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.6 t -151.25 100.31 2.74 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 108.652 -0.869 . . . . 75.34 108.652 173.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -56.95 -38.34 72.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.769 0.828 . . . . 73.45 110.288 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.539 HD11 HD12 ' A' ' 105' ' ' LEU . 31.8 tp -59.91 -45.08 93.72 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 124.124 0.89 . . . . 65.45 110.492 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.61 -43.41 96.94 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.1 0.56 . . . . 64.15 111.645 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -56.29 -50.65 70.82 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 124.14 0.9 . . . . 70.22 110.758 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 93.4 mm-40 -66.4 -39.03 88.77 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 124.299 1.0 . . . . 73.11 112.365 -177.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.439 HG21 HD21 ' A' ' 77' ' ' LEU . 77.8 mt -64.94 -50.61 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 122.561 0.344 . . . . 53.23 110.883 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -67.51 -31.43 71.54 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.696 0.398 . . . . 72.22 111.736 179.54 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.8 tp -69.98 -53.59 17.05 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.04 0.536 . . . . 74.35 110.734 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -71.95 -29.32 64.14 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.672 -0.694 . . . . 64.23 111.205 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.645 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 37.9 m -132.29 93.23 26.34 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 123.119 0.568 . . . . 53.44 110.009 -176.786 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.29 -10.43 22.41 Favored 'Trans proline' 0 C--N 1.37 1.689 0 C-N-CA 122.981 2.454 . . . . 62.42 113.357 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -82.18 -3.05 90.69 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-O 119.988 -0.34 . . . . 64.21 113.407 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 91.7 t -77.18 121.73 30.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 C-N-CA 123.542 0.737 . . . . 75.01 109.66 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -74.47 -48.78 25.3 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.854 0.862 . . . . 74.43 109.706 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.8 t -162.5 154.81 19.02 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.401 -1.272 . . . . 45.43 110.717 -170.294 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.439 HD21 HG21 ' A' ' 67' ' ' ILE . 36.2 mt -108.35 158.11 17.79 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.096 1.359 . . . . 73.1 108.745 169.614 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.439 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.0 ttm -137.49 113.92 10.21 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.246 -1.02 . . . . 75.35 108.246 170.439 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.602 HD13 HD13 ' A' ' 84' ' ' LEU . 22.0 mm -88.91 118.55 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 N-CA-C 107.958 -1.127 . . . . 63.24 107.958 -175.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -108.51 -164.21 20.86 Favored Glycine 0 C--O 1.242 0.652 0 N-CA-C 111.852 -0.499 . . . . 75.45 111.852 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -73.13 -74.68 0.16 Allowed 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.302 -0.999 . . . . 70.45 108.302 174.125 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -87.48 -19.79 27.46 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.088 1.355 . . . . 74.14 111.122 -176.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -119.77 160.49 22.49 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.808 0.67 . . . . 74.24 112.808 -164.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 79' ' ' ILE . 28.3 tp -135.99 109.77 8.11 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.415 -1.266 . . . . 73.01 107.803 170.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.439 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 36.9 m -96.21 108.44 20.91 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.317 -0.623 . . . . 74.24 109.317 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 26.3 mm -90.67 127.56 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 108.984 -0.747 . . . . 55.42 108.984 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -107.8 128.52 54.67 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 108.011 -1.107 . . . . 55.55 108.011 178.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.6 170.25 16.25 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.75 0.82 . . . . 74.53 110.106 178.35 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -85.26 134.78 34.12 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 109.515 -0.55 . . . . 74.32 109.515 173.328 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.2 ptp180 -55.1 -31.31 61.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.31 1.044 . . . . 70.13 113.656 -174.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 84.0 mtp -67.49 -26.79 66.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 122.721 0.408 . . . . 74.11 111.146 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 18.6 t -89.41 136.5 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 107.902 -1.147 . . . . 73.0 107.902 173.651 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -91.85 150.51 21.02 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.899 0.48 . . . . 73.22 111.537 -173.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -68.09 -15.71 63.71 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.243 0.617 . . . . 71.21 110.49 169.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -57.7 -31.01 65.97 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.115 0.966 . . . . 73.41 111.555 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.9 t -103.19 -17.12 15.49 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.406 0.682 . . . . 71.22 111.405 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.645 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 68.3 mt -100.96 -58.64 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 122.961 0.504 . . . . 70.54 111.13 -171.266 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.503 ' HD2' HG21 ' A' ' 21' ' ' THR . 27.7 ttpp -59.92 -46.24 98.2 Favored Pre-proline 0 CA--C 1.567 1.602 0 N-CA-C 114.606 1.336 . . . . 70.12 114.606 -170.462 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -60.29 -35.16 92.61 Favored 'Trans proline' 0 C--N 1.396 3.057 0 CA-C-N 122.002 1.751 . . . . 72.35 112.02 178.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -66.74 -46.45 75.39 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.463 -0.79 . . . . 63.42 109.837 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.41 ' O ' HD13 ' A' ' 105' ' ' LEU . 50.1 mt -67.42 -45.86 84.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 O-C-N 123.979 0.799 . . . . 74.33 111.528 -177.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.69 -40.67 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 122.746 0.418 . . . . 73.44 110.694 178.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -64.27 -41.28 96.99 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.894 0.746 . . . . 64.42 110.91 177.052 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.5 -36.84 85.49 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.639 0.776 . . . . 62.35 111.398 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.539 HD12 HD11 ' A' ' 63' ' ' LEU . 8.2 mp -69.25 -33.4 73.2 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.477 0.711 . . . . 61.13 109.939 175.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.9 m -71.27 -34.6 70.85 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.176 0.59 . . . . 61.13 109.642 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -69.09 -56.64 7.09 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 122.975 0.51 . . . . 64.13 110.266 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.92 -42.94 85.85 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.681 1.192 . . . . 71.31 111.24 -173.098 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.518 HD22 ' HB3' ' A' ' 38' ' ' GLU . 95.8 mt -73.42 -34.82 65.67 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.123 0.569 . . . . 72.54 111.418 178.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.16 -29.27 68.12 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 122.965 0.506 . . . . 71.15 111.35 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -74.3 -34.55 63.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.802 -0.635 . . . . 71.35 110.063 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.15 35.55 53.03 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-N 115.535 -0.757 . . . . 72.11 112.358 -179.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -98.74 -179.93 4.46 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.642 0.777 . . . . 72.41 110.705 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -87.81 143.38 27.17 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.936 0.494 . . . . 74.45 110.04 174.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 7.7 p -76.3 -39.98 35.19 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 N-CA-C 109.341 -0.614 . . . . 75.05 109.341 171.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.533 HD11 HD11 ' A' ' 50' ' ' ILE . 78.5 mt -140.13 125.95 21.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.692 1.197 . . . . 64.13 108.883 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 34.1 t -79.3 87.13 5.0 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 108.784 -0.821 . . . . 74.3 108.784 173.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -67.61 -24.58 65.49 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.041 -0.981 . . . . 73.43 110.384 176.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 . . . . . 0 CA--C 1.554 1.119 0 C-N-CA 123.625 0.77 . . . . 75.31 110.13 178.708 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 109.325 -0.62 . . . . 62.21 109.325 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.65 93.78 1.16 Allowed Glycine 0 C--N 1.343 0.959 0 CA-C-N 115.664 -0.698 . . . . 70.25 111.943 176.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -75.35 111.62 10.82 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 109.433 -0.58 . . . . 63.13 109.433 175.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 17.4 t-80 -79.64 102.79 9.13 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.321 0.648 . . . . 73.01 109.437 -177.243 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -72.67 147.96 45.21 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.046 0.538 . . . . 75.14 111.621 -178.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -123.53 113.25 18.47 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.531 0.732 . . . . 74.15 109.791 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -141.18 122.98 15.31 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.726 0.81 . . . . 71.41 109.201 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -136.08 101.24 4.65 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 107.195 -1.409 . . . . 74.21 107.195 173.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.0 t -105.05 170.86 7.63 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 123.222 0.609 . . . . 71.23 110.925 -173.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.9 p-80 -157.08 143.93 18.43 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 124.773 1.229 . . . . 74.23 108.288 178.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -120.94 146.84 46.22 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 109.149 -0.686 . . . . 73.22 109.149 175.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -67.33 86.42 0.17 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.371 1.069 . . . . 72.53 109.67 -178.456 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.1 m -77.52 111.07 12.86 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.932 0.893 . . . . 74.44 109.349 -176.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -113.48 157.42 22.0 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.783 0.833 . . . . 74.33 111.251 -174.191 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -100.14 26.89 6.02 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.093 -0.958 . . . . 74.42 109.894 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.6 mt -84.0 -164.09 0.88 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.028 0.931 . . . . 71.44 111.968 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.72 134.54 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 124.715 1.206 . . . . 64.01 112.042 -163.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.1 m80 -87.71 137.28 32.47 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 125.108 1.363 . . . . 63.12 109.393 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.404 ' HB ' HG23 ' A' ' 102' ' ' ILE . 51.5 mm -121.76 117.16 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 107.019 -1.474 . . . . 73.33 107.019 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.527 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.8 ttmm -90.62 138.0 31.91 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.465 -0.939 . . . . 73.53 108.465 -178.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 85.2 m -105.55 124.61 49.84 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 108.395 -0.965 . . . . 65.45 108.395 174.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.6 mt -117.54 136.26 53.37 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 108.747 -0.834 . . . . 73.15 108.747 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.3 p -68.06 144.68 54.99 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.854 0.862 . . . . 73.43 110.432 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.3 p -126.2 147.84 61.18 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.364 1.066 . . . . 71.43 109.312 -173.368 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.94 -28.91 66.81 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 122.537 2.158 . . . . 64.44 112.033 171.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -87.16 117.23 25.77 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.196 0.999 . . . . 45.42 108.718 176.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -73.82 -29.78 62.34 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.535 0.734 . . . . 74.45 112.342 -175.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -74.35 -26.36 60.09 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 122.644 0.378 . . . . 73.11 110.588 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -90.11 158.91 17.06 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.411 0.684 . . . . 65.14 110.856 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.3 tp -158.67 123.13 4.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.335 -0.987 . . . . 64.14 108.335 168.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -84.22 129.95 34.86 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.041 0.936 . . . . 65.22 110.636 -174.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -118.57 118.56 32.01 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.257 1.023 . . . . 73.04 108.512 174.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.527 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 60.6 tp -100.88 124.65 46.87 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 109.218 -0.66 . . . . 74.33 109.218 -172.792 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.0 m -80.92 105.37 12.09 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.453 -0.943 . . . . 74.35 108.453 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 57.2 p -91.52 -6.16 52.97 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 112.943 0.719 . . . . 63.04 112.943 -168.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -97.15 178.02 5.39 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.075 0.95 . . . . 72.1 109.442 178.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.42 -11.72 29.16 Favored Glycine 0 N--CA 1.48 1.613 0 N-CA-C 114.208 0.443 . . . . 61.41 114.208 -175.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.471 ' HB3' HD22 ' A' ' 109' ' ' LEU . 11.4 mp0 -81.23 89.02 6.01 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.52 1.128 . . . . 72.44 109.832 175.322 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.7 ttt -93.53 136.45 33.8 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 108.063 -1.088 . . . . 61.34 108.063 172.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.405 ' HB3' HG11 ' A' ' 115' ' ' VAL . 77.5 mt -68.53 -59.51 3.09 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.933 0.493 . . . . 71.54 112.106 -167.494 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.534 ' HB2' ' HA ' ' A' ' 81' ' ' ASP . 26.3 mt-30 -117.32 171.08 8.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.721 0.808 . . . . 70.31 109.46 172.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 5.0 t -74.26 149.0 40.97 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 109.371 -0.603 . . . . 75.24 109.371 169.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.2 ttt85 -72.79 129.54 38.42 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.542 0.337 . . . . 73.32 111.097 -174.53 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 95.66 26.94 11.01 Favored Glycine 0 C--N 1.343 0.931 0 O-C-N 123.852 0.72 . . . . 72.21 112.044 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.3 m -97.48 -177.54 3.84 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.628 0.771 . . . . 73.13 110.584 176.389 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -94.64 132.47 39.32 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 108.385 -0.969 . . . . 73.2 108.385 173.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.3 p -70.01 115.71 9.53 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.661 0.785 . . . . 64.03 110.217 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.1 mt -74.33 102.02 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 109.017 -0.734 . . . . 74.43 109.017 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 89.7 t -91.65 106.97 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.604 -0.888 . . . . 60.34 108.604 -179.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.508 HG12 ' HB3' ' A' ' 57' ' ' LEU . 66.4 mt -104.39 110.0 29.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 N-CA-C 108.065 -1.087 . . . . 60.43 108.065 -178.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' HB3' ' A' ' 76' ' ' SER . 54.1 mtmt -91.34 161.24 15.1 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.247 -0.649 . . . . 71.11 109.247 177.718 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.451 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 27.6 p30 -63.64 -18.27 63.76 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.0 0.92 . . . . 72.02 112.307 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -82.85 -27.17 31.0 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.67 0.788 . . . . 62.21 111.735 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.445 ' O ' HG13 ' A' ' 58' ' ' ILE . 31.1 m-20 -83.67 77.17 9.91 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.519 0.728 . . . . 72.42 111.601 -173.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -49.68 -46.31 49.78 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.196 0.998 . . . . 52.42 112.084 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -54.19 -48.02 71.43 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.495 1.118 . . . . 75.23 111.467 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.508 ' HB3' HG12 ' A' ' 50' ' ' ILE . 83.6 mt -73.6 -28.96 62.1 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 115.525 -0.761 . . . . 73.13 111.347 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.487 HG22 ' HG2' ' A' ' 65' ' ' GLN . 87.9 mt -70.81 -39.32 75.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 123.508 0.723 . . . . 63.43 110.393 178.23 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 29.8 m120 -66.16 -23.55 66.49 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.556 0.342 . . . . 74.44 111.516 174.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -72.05 -10.68 60.11 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 112.869 0.692 . . . . 75.33 112.869 172.383 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.417 ' OG ' HG12 ' A' ' 116' ' ' ILE . 17.4 m -140.83 105.31 4.87 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 122.841 0.456 . . . . 74.44 110.513 -177.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -59.31 -32.8 70.39 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.62 0.768 . . . . 74.45 110.401 174.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.2 tp -60.3 -44.73 95.15 Favored 'General case' 0 C--N 1.356 0.849 0 C-N-CA 123.988 0.915 . . . . 35.45 110.876 175.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.94 99.47 Favored 'General case' 0 C--N 1.357 0.906 0 O-C-N 123.845 0.715 . . . . 61.12 110.511 -178.419 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.487 ' HG2' HG22 ' A' ' 58' ' ' ILE . 82.8 mt-30 -57.4 -43.89 84.06 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 124.509 1.13 . . . . 72.0 110.862 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -69.23 -39.29 78.61 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 123.569 0.543 . . . . 53.13 112.026 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.461 HG21 HD21 ' A' ' 77' ' ' LEU . 59.8 mt -64.99 -49.07 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.435 0.694 . . . . 61.13 110.658 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -69.88 -27.23 64.64 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.121 0.568 . . . . 73.43 111.602 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 66.6 tp -69.66 -48.52 59.54 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.141 0.576 . . . . 74.43 110.845 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -74.48 -33.37 62.85 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.432 -0.804 . . . . 64.25 111.442 -177.352 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 52.4 t -142.95 94.18 6.48 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 108.759 -0.83 . . . . 74.34 108.759 -178.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -71.44 -2.01 10.61 Favored 'Trans proline' 0 C--N 1.373 1.851 0 C-N-CA 123.245 2.63 . . . . 75.41 112.733 174.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.69 -20.24 74.34 Favored Glycine 0 C--N 1.355 1.608 0 N-CA-C 111.687 -0.565 . . . . 74.25 111.687 177.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 85.9 t -65.39 118.3 7.68 Favored 'Isoleucine or valine' 0 C--N 1.354 0.789 0 C-N-CA 123.649 0.78 . . . . 62.23 109.713 175.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.451 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 40.5 mt-10 -82.15 -41.98 19.69 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.205 1.002 . . . . 44.44 110.871 -175.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.509 ' HB3' ' HG2' ' A' ' 51' ' ' LYS . 74.6 p -159.14 165.53 33.57 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.632 0.73 . . . . 61.51 111.999 -175.734 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.461 HD21 HG21 ' A' ' 67' ' ' ILE . 46.5 mt -129.1 127.78 42.16 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 106.905 -1.517 . . . . 72.4 106.905 176.08 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.495 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.3 ttm -103.32 109.1 20.59 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 108.11 -1.07 . . . . 64.02 108.11 173.177 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.694 HG13 HD11 ' A' ' 116' ' ' ILE . 13.6 mm -84.29 103.8 11.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 107.046 -1.465 . . . . 71.4 107.046 177.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.97 -168.74 43.14 Favored Glycine 0 C--O 1.245 0.816 0 N-CA-C 111.617 -0.593 . . . . 71.45 111.617 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.534 ' HA ' ' HB2' ' A' ' 41' ' ' GLN . 1.9 m-20 -76.26 -61.63 1.88 Allowed 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.678 -0.86 . . . . 74.42 108.678 -178.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -97.04 -14.73 21.42 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.112 0.965 . . . . 72.14 111.361 -178.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -134.65 156.25 49.07 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.381 0.512 . . . . 61.1 112.381 -159.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.61 HD13 HD13 ' A' ' 79' ' ' ILE . 22.6 tp -125.14 114.97 19.73 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.889 1.275 . . . . 74.22 107.921 174.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.495 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 30.8 m -102.44 108.86 20.33 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.452 -0.944 . . . . 70.04 108.452 -178.063 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.0 mm -87.4 136.95 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 107.908 -1.145 . . . . 70.41 107.908 -178.07 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -123.07 126.43 47.07 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 108.657 -0.868 . . . . 71.14 108.657 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -129.01 167.43 17.48 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.333 0.653 . . . . 74.34 109.573 177.111 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -59.71 141.94 54.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.075 0.95 . . . . 63.21 110.01 174.099 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -54.38 -38.8 66.56 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.513 0.725 . . . . 73.25 112.275 -172.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 45.3 ttp -75.81 -28.13 58.21 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.618 0.767 . . . . 71.32 111.216 -175.105 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.405 HG12 HD11 ' A' ' 97' ' ' ILE . 44.3 t -72.04 134.47 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 N-CA-C 108.458 -0.942 . . . . 63.44 108.458 172.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -104.13 160.78 14.57 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.149 0.579 . . . . 75.41 110.929 -176.072 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -77.94 -13.78 59.76 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.471 1.109 . . . . 72.43 113.547 -175.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -64.56 -28.36 69.59 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.28 0.632 . . . . 75.21 111.919 -171.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.2 m -95.24 -23.93 17.02 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.779 0.832 . . . . 72.52 111.546 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.405 HD11 HG12 ' A' ' 92' ' ' VAL . 50.7 mt -89.98 -48.93 14.13 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 123.813 0.845 . . . . 73.55 111.294 -168.61 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -51.62 -55.51 29.05 Favored Pre-proline 0 N--CA 1.487 1.395 0 CA-C-O 117.428 -1.272 . . . . 74.21 113.282 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -59.85 -38.19 81.33 Favored 'Trans proline' 0 C--N 1.396 3.049 0 CA-C-N 121.577 1.599 . . . . 63.1 112.314 -175.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.45 -48.03 57.86 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.049 0.54 . . . . 61.24 110.523 -175.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 13.1 mt -69.95 -45.23 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.49 0.716 . . . . 63.21 111.186 -178.166 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.404 HG23 ' HB ' ' A' ' 19' ' ' ILE . 58.1 mt -58.41 -37.4 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.067 0.547 . . . . 74.42 110.813 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -67.84 -45.77 73.7 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 123.687 0.617 . . . . 60.51 110.279 175.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.5 mt -60.11 -33.74 72.53 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 123.867 0.867 . . . . 71.1 111.588 177.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.5 mp -74.05 -35.34 64.3 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.171 0.988 . . . . 65.05 110.654 178.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 85.5 m -72.07 -31.19 65.87 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 109.293 -0.632 . . . . 43.45 109.293 178.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.535 ' HA ' ' HE2' ' A' ' 107' ' ' LYS . 10.1 mmpt? -73.32 -52.96 12.02 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 123.932 0.893 . . . . 62.52 111.101 175.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 17.8 tt0 -55.7 -53.14 60.3 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.783 0.833 . . . . 74.44 111.043 -178.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.471 HD22 ' HB3' ' A' ' 38' ' ' GLU . 78.7 mt -74.12 -10.8 59.98 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 114.844 -1.071 . . . . 73.42 111.417 -176.197 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.84 -27.4 62.87 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.706 0.402 . . . . 45.32 110.845 170.226 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -79.62 -52.04 8.49 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 107.51 -1.293 . . . . 75.44 107.51 168.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.82 -8.6 75.16 Favored Glycine 0 C--N 1.354 1.582 0 N-CA-C 115.838 1.095 . . . . 75.15 115.838 163.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.18 -70.46 0.27 Allowed 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 117.669 0.734 . . . . 52.02 111.108 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -134.1 126.09 29.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.122 0.569 . . . . 72.22 110.762 -171.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.405 HG11 ' HB3' ' A' ' 40' ' ' LEU . 3.9 p -75.35 -43.94 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 107.997 -1.112 . . . . 62.34 107.997 158.559 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.694 HD11 HG13 ' A' ' 79' ' ' ILE . 29.4 mt -132.78 142.08 43.3 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 C-N-CA 125.326 1.45 . . . . 63.41 107.218 170.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.3 p -57.61 118.92 5.73 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.056 0.942 . . . . 55.53 110.972 177.241 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.98 84.51 1.76 Allowed 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 122.091 0.948 . . . . 73.31 110.874 178.4 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 CA--C 1.555 1.153 0 C-N-CA 124.295 1.038 . . . . 64.23 109.747 -179.274 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptt? . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 110.218 -0.289 . . . . 72.23 110.218 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.19 77.54 1.36 Allowed Glycine 0 C--N 1.347 1.148 0 O-C-N 123.314 0.384 . . . . 64.01 112.455 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -80.07 80.38 6.49 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 109.246 -0.65 . . . . 72.32 109.246 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . 0.434 ' HD2' ' HB2' ' A' ' 6' ' ' HIS . 38.0 p-80 -87.97 136.52 32.93 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.463 1.105 . . . . 64.14 110.738 -176.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -85.31 61.97 7.2 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.893 0.854 . . . . 75.25 110.964 177.407 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.434 ' HB2' ' HD2' ' A' ' 4' ' ' HIS . 70.1 m-70 -128.79 112.28 14.0 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.215 1.006 . . . . 61.34 108.672 175.56 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.429 ' CE1' ' HG ' ' A' ' 9' ' ' SER . 37.5 t-80 -130.15 135.71 48.49 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.548 1.139 . . . . 75.31 108.97 -179.221 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.1 p-80 -160.78 78.42 0.61 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.76 0.824 . . . . 53.41 109.938 178.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.429 ' HG ' ' CE1' ' A' ' 7' ' ' HIS . 60.2 p -100.6 79.01 2.04 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.459 0.703 . . . . 60.44 110.43 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -88.93 123.57 33.41 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.235 0.614 . . . . 73.43 109.487 177.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.1 ptt? -74.24 111.34 9.32 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.17 -0.678 . . . . 71.25 109.17 174.107 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -74.36 87.6 2.03 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 108.291 -1.003 . . . . 70.43 108.291 173.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.2 t -72.25 77.65 0.99 Allowed 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.949 0.88 . . . . 73.25 109.524 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -121.27 86.46 2.58 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 106.934 -1.506 . . . . 72.25 106.934 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.0 ttt180 -83.99 119.76 25.31 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 116.017 -0.538 . . . . 74.43 109.664 -175.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -147.67 140.98 25.22 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 108.997 -0.742 . . . . 72.24 108.997 173.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 106' ' ' THR . 74.7 mt -69.62 100.14 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 115.039 -0.982 . . . . 73.45 108.941 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.454 ' H ' ' HB3' ' A' ' 36' ' ' ASP . 48.2 m80 -68.32 120.54 14.61 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 124.293 1.037 . . . . 71.24 110.848 -174.371 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.4 mm -118.19 123.71 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 N-CA-C 108.079 -1.082 . . . . 73.52 108.079 -173.127 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.526 ' HE3' HD21 ' A' ' 22' ' ' LEU . 56.6 tptt -96.78 112.27 24.09 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.684 1.194 . . . . 75.12 109.108 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.452 HG21 ' HE3' ' A' ' 98' ' ' LYS . 59.8 m -92.49 113.47 25.76 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 108.847 -0.797 . . . . 74.45 108.847 -178.627 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.526 HD21 ' HE3' ' A' ' 20' ' ' LYS . 95.4 mt -122.26 138.01 54.64 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.625 1.17 . . . . 64.23 109.591 -171.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.4 p -81.02 147.81 30.01 Favored 'General case' 0 C--O 1.24 0.56 0 O-C-N 124.073 0.858 . . . . 64.11 110.553 -178.431 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 36.6 p -125.38 158.0 65.76 Favored Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 124.136 0.974 . . . . 75.03 109.373 -174.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.13 -32.1 30.79 Favored 'Trans proline' 0 C--N 1.389 2.679 0 C-N-CA 123.289 2.66 . . . . 70.23 113.684 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -100.71 121.46 41.7 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 108.918 -0.771 . . . . 74.21 108.918 173.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -73.82 -15.37 61.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.112 0.565 . . . . 74.01 111.303 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.436 ' O ' ' HA ' ' A' ' 87' ' ' ASN . 13.2 m120 -71.9 -19.05 61.99 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 122.655 0.382 . . . . 52.45 110.609 170.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -102.41 159.7 15.19 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.56 1.144 . . . . 71.32 110.082 172.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.0 tp -160.28 120.91 2.96 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.14 -0.689 . . . . 71.44 109.14 176.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.9 ttmp? -82.44 120.75 25.86 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.044 0.538 . . . . 73.3 111.131 -176.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -105.24 111.86 24.76 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.381 -0.97 . . . . 71.14 108.381 169.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 59.5 tp -108.83 128.28 54.76 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.669 0.787 . . . . 62.31 109.665 -171.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 p -80.5 104.53 11.1 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.909 -0.774 . . . . 74.31 108.909 179.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.5 p -101.11 -6.74 23.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.743 0.817 . . . . 55.33 111.302 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.454 ' HB3' ' H ' ' A' ' 18' ' ' HIS . 8.0 p-10 -69.44 -37.7 77.48 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.167 0.587 . . . . 75.43 110.316 177.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.31 -12.5 4.96 Favored Glycine 0 C--N 1.349 1.292 0 C-N-CA 123.371 0.51 . . . . 71.13 113.031 178.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.519 ' HG2' ' HB3' ' A' ' 109' ' ' LEU . 9.6 tp10 -78.04 149.03 34.06 Favored 'General case' 0 C--N 1.356 0.869 0 CA-C-N 117.567 0.683 . . . . 74.21 109.965 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 7.5 tpt -111.77 142.66 43.85 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.222 0.609 . . . . 72.44 109.992 -170.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.679 HD23 HD21 ' A' ' 109' ' ' LEU . 89.8 mt -86.0 -44.42 12.35 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.409 0.684 . . . . 74.45 111.378 -177.232 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.434 ' HG3' ' H ' ' A' ' 42' ' ' THR . 6.9 tp60 -135.17 -178.0 4.9 Favored 'General case' 0 CA--C 1.561 1.376 0 N-CA-C 109.194 -0.669 . . . . 64.43 109.194 -177.278 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.434 ' H ' ' HG3' ' A' ' 41' ' ' GLN . 5.3 m -74.8 -1.01 20.18 Favored 'General case' 0 CA--C 1.568 1.651 0 N-CA-C 114.608 1.336 . . . . 70.11 114.608 -160.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.47 67.91 0.38 Allowed 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.427 1.091 . . . . 71.42 108.648 -173.046 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 153.92 43.49 0.02 OUTLIER Glycine 0 C--N 1.342 0.872 0 CA-C-N 115.195 -0.911 . . . . 74.34 112.236 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.2 t -129.38 176.92 7.56 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.384 0.674 . . . . 40.23 109.817 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.28 -176.31 3.26 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.301 1.041 . . . . 71.44 110.185 177.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.5 m -73.49 92.88 1.93 Allowed 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 109.355 -0.609 . . . . 71.43 109.355 173.294 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.561 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 46.9 mt -75.35 97.87 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 108.758 -0.83 . . . . 65.4 108.758 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.4 t -86.83 107.27 16.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.017 -1.105 . . . . 74.33 108.017 -176.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.6 mt -102.59 108.4 24.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 107.884 -1.154 . . . . 72.11 107.884 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -95.66 155.96 16.53 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.195 0.598 . . . . 65.42 109.66 -176.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.442 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 34.5 p30 -60.47 -18.87 54.27 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.563 0.745 . . . . 72.42 112.364 -178.772 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.5 p -77.56 -41.27 39.53 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.774 0.83 . . . . 61.21 111.262 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -86.69 79.75 8.77 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.502 0.721 . . . . 73.54 110.552 -171.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -66.53 -22.82 66.17 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.28 -0.873 . . . . 74.32 112.21 -173.691 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -57.5 -46.88 83.24 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 121.052 0.453 . . . . 73.01 110.377 178.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.3 mt -73.2 -35.65 66.38 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.662 0.785 . . . . 63.14 110.523 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.402 HG22 ' HG2' ' A' ' 65' ' ' GLN . 72.1 mt -61.27 -42.54 93.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.337 1.055 . . . . 51.13 110.283 177.24 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASN . . . . . 0.433 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 83.1 m-20 -69.45 -29.19 66.83 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.159 0.584 . . . . 72.54 111.875 177.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.565 ' HB3' HG23 ' A' ' 116' ' ' ILE . 24.7 m80 -73.9 -33.14 63.88 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.142 0.577 . . . . 65.12 111.525 175.646 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.0 p -110.97 92.24 3.97 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 108.798 -0.816 . . . . 71.45 108.798 176.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -57.46 -23.4 49.61 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.718 0.807 . . . . 71.35 111.352 -175.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.405 HD11 HD12 ' A' ' 105' ' ' LEU . 62.4 tp -58.12 -46.73 85.09 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.062 1.345 . . . . 72.2 110.872 171.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.72 -39.27 93.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.939 0.896 . . . . 71.14 110.707 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.433 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 95.6 mt-30 -55.06 -47.84 74.31 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 123.651 0.594 . . . . 72.33 109.827 175.179 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -65.61 -45.31 83.64 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 115.135 -0.939 . . . . 74.1 112.845 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 69.2 mt -65.09 -49.1 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 123.112 0.565 . . . . 64.51 110.663 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -68.24 -30.12 69.1 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 116.107 -0.497 . . . . 75.41 111.372 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 41.0 tp -73.32 -46.99 46.17 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.107 0.563 . . . . 64.34 111.679 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 26.9 mt-30 -83.27 -17.42 42.65 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.316 0.647 . . . . 53.14 111.594 -173.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 51.6 t -141.96 105.58 5.73 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 123.352 0.661 . . . . 63.31 109.604 172.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.45 -8.53 22.77 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.949 2.433 . . . . 73.41 112.803 176.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.572 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -76.61 -21.9 73.78 Favored Glycine 0 C--N 1.345 1.037 0 CA-C-N 116.57 -0.286 . . . . 71.01 113.29 -178.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.53 122.68 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 122.989 0.516 . . . . 63.22 109.673 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.442 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 11.1 pt-20 -93.04 -33.77 13.97 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.755 0.822 . . . . 72.35 111.23 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.9 p -161.9 160.29 27.76 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.459 0.647 . . . . 63.44 112.023 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.411 HD22 HD12 ' A' ' 86' ' ' ILE . 40.7 mt -121.08 139.23 53.6 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.155 -1.424 . . . . 74.12 107.155 174.671 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.557 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 48.6 ttm -113.06 109.22 18.47 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 107.215 -1.402 . . . . 72.4 107.215 173.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.615 HG21 HG11 ' A' ' 115' ' ' VAL . 39.8 mm -92.49 127.18 44.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 109.342 -0.614 . . . . 72.21 109.342 -176.138 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -114.22 175.61 16.38 Favored Glycine 0 C--O 1.241 0.566 0 N-CA-C 109.677 -1.369 . . . . 41.24 109.677 166.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.413 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 23.5 m-20 -72.71 -44.61 61.5 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.582 0.706 . . . . 65.23 110.468 177.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -104.38 -39.51 6.42 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 125.014 1.326 . . . . 65.2 110.933 -174.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 18.1 p90 -111.21 155.58 22.73 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.292 0.637 . . . . 53.31 111.201 -175.467 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.46 HD21 HD11 ' A' ' 86' ' ' ILE . 54.3 tp -120.79 150.45 40.99 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 107.425 -1.324 . . . . 74.43 107.425 171.209 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 50.7 m -141.37 109.46 5.81 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.218 0.607 . . . . 43.45 109.76 175.798 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.499 HG13 HD13 ' A' ' 101' ' ' ILE . 29.5 mm -88.76 139.53 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 109.242 -0.651 . . . . 61.41 109.242 -178.685 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.436 ' HA ' ' O ' ' A' ' 28' ' ' ASN . 33.5 m-80 -118.35 133.82 55.56 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.454 0.702 . . . . 74.32 109.571 175.554 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.486 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -128.11 168.74 14.95 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.585 0.754 . . . . 71.32 109.978 -178.832 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 14.1 t70 -72.95 149.5 43.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.274 0.63 . . . . 71.55 110.179 173.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -50.14 -41.04 48.09 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.653 1.181 . . . . 65.44 114.184 -172.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 20.0 ptp -83.41 -18.03 40.14 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 122.752 0.421 . . . . 75.34 111.75 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.572 HG11 ' HA3' ' A' ' 73' ' ' GLY . 27.4 t -81.46 127.65 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.068 0.547 . . . . 72.44 109.545 -171.592 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -86.8 130.68 34.37 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.785 0.834 . . . . 74.21 110.601 -169.75 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.486 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 45.4 m95 -59.16 -31.41 68.96 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.507 0.723 . . . . 71.31 112.141 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -61.35 -26.19 67.66 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 122.767 0.427 . . . . 73.35 111.445 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.7 t -86.99 -18.73 29.97 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.698 0.799 . . . . 44.32 111.367 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.5 HD11 HG12 ' A' ' 92' ' ' VAL . 10.9 mt -104.09 -44.16 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.348 0 C-N-CA 123.043 0.537 . . . . 73.41 111.586 -170.51 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.452 ' HE3' HG21 ' A' ' 21' ' ' THR . 54.5 mtpt -52.91 -52.18 67.46 Favored Pre-proline 0 N--CA 1.491 1.595 0 C-N-CA 124.963 1.305 . . . . 74.24 113.706 -172.636 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -56.5 -40.07 87.0 Favored 'Trans proline' 0 C--N 1.393 2.919 0 C-N-CA 121.909 1.74 . . . . 74.24 112.049 -178.31 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.4 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 10.8 mm-40 -61.84 -53.76 51.44 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.79 -1.096 . . . . 75.31 110.03 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.499 HD13 HG13 ' A' ' 86' ' ' ILE . 48.2 mt -61.93 -51.06 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.077 0.951 . . . . 75.11 111.833 -176.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 83.2 mt -58.56 -40.17 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 123.308 0.643 . . . . 73.3 110.824 -177.904 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -66.99 -42.51 84.9 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.944 0.498 . . . . 63.24 110.74 178.352 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 90.7 mt -65.79 -35.57 81.08 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.163 0.985 . . . . 63.51 111.757 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.405 HD12 HD11 ' A' ' 63' ' ' LEU . 6.5 mp -62.36 -35.94 80.69 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.687 0.795 . . . . 63.31 109.95 174.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.541 ' HA ' HD12 ' A' ' 17' ' ' ILE . 26.3 m -74.26 -29.83 61.85 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.073 0.549 . . . . 63.24 110.054 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -65.53 -52.41 52.81 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.456 0.702 . . . . 65.12 110.31 174.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -66.88 -52.62 41.24 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.306 -0.861 . . . . 73.42 111.744 -174.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.679 HD21 HD23 ' A' ' 40' ' ' LEU . 95.4 mt -67.56 -18.03 64.86 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.551 -0.75 . . . . 61.13 111.528 -174.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.33 -19.4 65.45 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.717 0.807 . . . . 71.42 112.032 174.017 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -74.73 -29.23 61.1 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.992 0.517 . . . . 62.32 110.434 173.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.97 28.04 63.32 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.947 -0.57 . . . . 74.33 112.85 -177.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -115.81 -178.65 3.44 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.216 1.006 . . . . 62.12 110.064 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -70.14 169.47 13.49 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.189 0.596 . . . . 62.34 110.336 172.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.615 HG11 HG21 ' A' ' 79' ' ' ILE . 7.1 p -67.54 -36.13 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.896 0.878 . . . . 63.33 109.707 175.728 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.565 HG23 ' HB3' ' A' ' 60' ' ' HIS . 83.8 mt -98.96 137.73 25.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 C-N-CA 124.644 1.178 . . . . 71.22 107.913 173.248 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 64.7 m -59.42 105.33 0.34 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 122.855 0.462 . . . . 65.32 109.796 175.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -63.33 -50.68 69.05 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.366 1.066 . . . . 74.25 110.839 -177.147 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 . . . . . 0 C--O 1.254 1.297 0 C-N-CA 125.116 1.366 . . . . 65.32 110.938 -177.182 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 ptp . . . . . 0 N--CA 1.48 1.028 0 CA-C-O 120.394 0.14 . . . . 73.43 110.985 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -76.48 75.18 1.64 Allowed Glycine 0 C--N 1.353 1.497 0 N-CA-C 112.191 -0.363 . . . . 74.11 112.191 178.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 44.6 t-80 -71.79 120.13 16.94 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.875 0.87 . . . . 63.2 109.665 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -128.58 92.56 3.44 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.332 0.653 . . . . 70.52 110.826 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -140.23 131.47 26.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.824 1.25 . . . . 72.54 108.721 168.655 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.4 p-80 -154.19 162.84 40.92 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.933 0.493 . . . . 71.12 110.796 179.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 47.3 t60 -164.66 94.16 0.68 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.329 0.652 . . . . 50.22 110.456 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 29.7 p-80 -86.61 129.06 35.01 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.259 0.624 . . . . 73.51 109.515 170.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.1 m -158.47 109.11 2.11 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.988 0.915 . . . . 51.15 109.355 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -105.61 102.54 11.99 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.345 -0.613 . . . . 72.43 109.345 174.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.8 ttt -79.21 84.93 5.12 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.763 -0.828 . . . . 73.23 108.763 175.251 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -70.59 122.81 20.45 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.302 0.641 . . . . 61.23 109.592 175.142 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.2 t -70.82 154.2 42.05 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.372 0.669 . . . . 70.3 110.375 175.479 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -133.42 152.78 51.95 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 108.48 -0.933 . . . . 74.2 108.48 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 62.18 79.38 0.26 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.996 1.318 . . . . 72.13 109.775 -169.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.529 ' H ' HD23 ' A' ' 16' ' ' LEU . 1.9 pt? -110.65 127.64 55.36 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 114.387 -1.279 . . . . 72.31 107.735 174.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.7 mt -76.6 113.08 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.038 0.535 . . . . 62.01 110.747 -170.123 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -77.31 112.92 14.53 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.254 1.021 . . . . 72.54 110.627 -175.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.448 ' HB ' HG23 ' A' ' 102' ' ' ILE . 50.1 mm -121.63 119.24 58.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 106.69 -1.596 . . . . 72.34 106.69 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -112.25 130.88 55.78 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.843 -1.169 . . . . 73.22 107.843 178.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.1 m -111.01 112.58 24.5 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.469 -0.567 . . . . 71.42 109.469 -175.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -97.62 139.67 33.17 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 123.396 0.678 . . . . 70.11 109.95 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 64.5 p -84.65 150.79 24.9 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.765 0.826 . . . . 74.45 110.223 -176.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 54.4 p -126.66 145.85 54.8 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.589 0.756 . . . . 63.14 109.587 -174.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -52.74 -41.08 71.99 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 123.203 2.602 . . . . 50.33 113.246 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -73.53 111.9 9.1 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.2 0.6 . . . . 60.44 109.858 172.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -71.99 -16.99 62.08 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.239 1.016 . . . . 65.0 112.368 -172.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -89.73 6.75 40.13 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.737 0.815 . . . . 61.12 111.5 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -135.47 159.34 41.9 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.391 1.077 . . . . 61.54 109.353 174.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.9 tp -156.86 127.55 6.66 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.314 -0.625 . . . . 74.52 109.314 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.54 114.7 26.97 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.367 0.667 . . . . 72.23 111.258 -173.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -103.19 125.35 49.83 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.748 1.219 . . . . 74.51 108.2 170.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.5 tp -130.71 136.69 49.02 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.501 0.72 . . . . 75.41 109.34 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.4 m -91.05 112.41 24.3 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.77 -0.826 . . . . 72.51 108.77 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.2 p -75.9 -5.74 47.56 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.249 0.62 . . . . 64.44 112.423 -174.497 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -71.0 -31.26 67.74 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.174 0.59 . . . . 65.43 110.141 169.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.96 36.28 3.23 Favored Glycine 0 C--N 1.344 1.01 0 CA-C-N 115.475 -0.784 . . . . 72.54 111.986 -174.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.404 ' HB3' HD22 ' A' ' 109' ' ' LEU . 22.7 mm-40 -83.71 81.87 8.57 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.545 0.688 . . . . 74.33 109.449 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 52.2 ttm -74.67 133.14 42.13 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 114.97 -1.013 . . . . 64.31 109.871 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 84' ' ' LEU . 75.4 mt -78.12 -57.67 3.66 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.238 0.615 . . . . 72.52 110.494 -174.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.523 ' HB2' ' HA ' ' A' ' 81' ' ' ASP . 10.1 mm100 -103.97 -157.84 0.63 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.387 1.075 . . . . 73.35 109.143 -177.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 90.5 m -86.37 147.65 25.94 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.935 0.894 . . . . 73.41 109.012 171.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -61.17 118.17 6.49 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-N 118.671 0.669 . . . . 75.14 110.468 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 99.82 18.17 23.54 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-O 119.708 -0.496 . . . . 64.51 113.219 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 73.7 m -78.71 172.62 13.46 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 117.396 0.598 . . . . 73.53 111.779 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.2 mmpt? -87.82 154.07 20.84 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.103 0.961 . . . . 73.54 110.329 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.4 m -77.65 91.9 4.06 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.571 0.748 . . . . 52.51 109.63 177.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.438 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 64.5 mt -73.47 109.15 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.311 1.044 . . . . 65.25 109.678 -175.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.2 t -87.04 110.06 19.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 109.225 -0.657 . . . . 71.15 109.225 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.416 HG23 ' HB2' ' A' ' 57' ' ' LEU . 76.0 mt -106.61 107.83 23.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 107.556 -1.275 . . . . 65.41 107.556 174.361 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -92.37 165.26 13.16 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 109.68 -0.489 . . . . 74.3 109.68 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -64.79 -24.46 67.56 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.507 0.723 . . . . 75.41 111.759 178.184 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.0 t -79.48 -22.88 43.47 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.403 0.681 . . . . 74.24 110.672 176.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -90.16 63.18 5.73 Favored 'General case' 0 C--N 1.354 0.771 0 C-N-CA 123.604 0.762 . . . . 63.22 109.894 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.478 ' HA ' HD12 ' A' ' 58' ' ' ILE . 38.1 tt0 -65.45 -23.82 67.02 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.897 -0.592 . . . . 75.35 110.466 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -61.67 -40.65 95.7 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.092 0.957 . . . . 62.31 111.278 175.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.416 ' HB2' HG23 ' A' ' 50' ' ' ILE . 96.0 mt -71.86 -41.38 68.16 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.273 0.629 . . . . 74.1 110.007 176.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.478 HD12 ' HA ' ' A' ' 55' ' ' GLU . 79.9 mt -59.2 -37.76 70.48 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 124.356 1.062 . . . . 73.12 111.103 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -58.47 -34.43 70.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.48 0.712 . . . . 74.25 111.699 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 53.0 m80 -94.95 13.71 24.07 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.031 0.932 . . . . 75.44 111.525 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.4 m -138.4 96.51 3.18 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.726 0.81 . . . . 53.01 109.793 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -55.73 -44.89 77.94 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.549 1.139 . . . . 73.03 112.388 -177.731 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.583 ' HB3' HG23 ' A' ' 115' ' ' VAL . 51.1 tp -61.1 -39.52 90.26 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.355 -0.839 . . . . 75.35 111.464 177.39 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.65 -43.52 96.52 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.906 0.483 . . . . 73.03 111.396 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -56.29 -47.56 78.41 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 123.993 0.808 . . . . 53.32 110.612 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.55 ' HB3' HD22 ' A' ' 104' ' ' LEU . 27.2 mm-40 -62.14 -44.98 95.43 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.754 0.822 . . . . 65.34 113.09 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.422 HG21 HD21 ' A' ' 77' ' ' LEU . 81.3 mt -65.13 -49.93 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.255 0.622 . . . . 75.21 110.863 -177.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -69.56 -26.21 64.38 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 111.988 0.366 . . . . 74.1 111.988 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.8 tp -72.5 -60.09 2.4 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 122.993 0.517 . . . . 63.44 111.268 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -81.35 -21.57 39.03 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.765 -0.652 . . . . 70.22 111.398 -171.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.521 ' SG ' HG23 ' A' ' 97' ' ' ILE . 60.1 m -124.44 92.73 47.6 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 123.612 0.765 . . . . 74.24 109.472 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.03 -10.75 26.51 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 123.004 2.47 . . . . 73.13 113.337 -177.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.441 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -100.6 46.63 1.32 Allowed Glycine 0 C--N 1.348 1.244 0 C-N-CA 122.759 0.219 . . . . 32.21 112.721 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 94.8 t -122.26 125.34 72.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 123.742 0.817 . . . . 74.32 109.187 170.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -87.82 -42.43 12.56 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.76 0.424 . . . . 75.15 111.158 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.1 t -152.98 165.51 35.33 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.061 0.458 . . . . 52.23 111.272 -172.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.422 HD21 HG21 ' A' ' 67' ' ' ILE . 79.1 mt -128.62 130.02 46.7 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 124.61 1.164 . . . . 71.25 108.143 175.851 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.542 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.7 ttm -107.72 101.88 11.15 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.53 -1.285 . . . . 61.4 107.53 174.801 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.438 ' HB ' ' HB ' ' A' ' 48' ' ' ILE . 45.8 mm -83.55 100.69 7.31 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 108.221 -1.029 . . . . 63.34 108.221 -176.061 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -83.06 172.06 51.09 Favored Glycine 0 C--O 1.248 0.973 0 N-CA-C 109.715 -1.354 . . . . 72.32 109.715 174.412 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.523 ' HA ' ' HB2' ' A' ' 41' ' ' GLN . 10.9 p-10 -70.07 -51.76 29.29 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 110.122 -0.325 . . . . 74.11 110.122 -178.415 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -99.58 -39.82 8.12 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.229 0.612 . . . . 70.33 109.847 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -95.76 163.03 13.35 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.522 0.729 . . . . 74.35 111.67 -170.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.54 ' HB2' HD11 ' A' ' 40' ' ' LEU . 67.3 tp -130.03 113.42 14.53 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.747 -0.834 . . . . 64.44 108.747 175.255 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.542 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 51.3 m -105.69 109.93 22.06 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.207 -0.664 . . . . 63.25 109.207 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.419 HG13 HG21 ' A' ' 101' ' ' ILE . 28.9 mm -87.83 133.76 29.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 107.77 -1.196 . . . . 74.31 107.77 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 12.4 m120 -114.44 134.0 55.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.417 0.687 . . . . 72.02 109.32 -177.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.457 ' NZ ' HD12 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -140.07 174.6 10.35 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.432 0.634 . . . . 75.02 111.426 175.285 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -86.49 147.73 25.85 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.917 -1.038 . . . . 70.03 109.08 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.6 ptt180 -76.81 -1.94 30.75 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 112.826 0.676 . . . . 75.21 112.826 -173.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 66.9 mtt -79.35 -24.49 42.68 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 109.854 -0.424 . . . . 73.21 109.854 172.63 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.441 HG11 ' HA3' ' A' ' 73' ' ' GLY . 60.1 t -98.29 142.27 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.909 0.883 . . . . 55.12 108.717 177.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -88.82 142.35 27.74 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.864 0.866 . . . . 74.31 111.556 -175.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.407 ' CD2' ' HE2' ' A' ' 88' ' ' LYS . 52.7 m95 -71.54 -45.37 62.51 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.967 0.507 . . . . 71.51 111.064 172.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -50.44 -32.21 17.22 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 124.56 1.144 . . . . 74.32 112.572 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.4 m -73.97 -54.32 8.16 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-N 115.467 -0.788 . . . . 75.04 110.839 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.521 HG23 ' SG ' ' A' ' 71' ' ' CYS . 10.5 mt -81.33 -22.4 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 124.318 1.047 . . . . 75.03 112.376 -170.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.69 -50.57 84.7 Favored Pre-proline 0 CA--C 1.557 1.246 0 C-N-CA 124.316 1.046 . . . . 74.41 113.512 -168.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -62.3 -28.44 78.85 Favored 'Trans proline' 0 C--N 1.385 2.49 0 C-N-CA 121.564 1.509 . . . . 65.33 111.97 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -70.68 -40.31 73.02 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.973 0.909 . . . . 71.04 111.219 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.419 HG21 HG13 ' A' ' 86' ' ' ILE . 71.4 mt -68.99 -45.9 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 N-CA-C 109.811 -0.44 . . . . 73.45 109.811 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.448 HG23 ' HB ' ' A' ' 19' ' ' ILE . 88.4 mt -53.57 -40.63 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.585 0.754 . . . . 54.12 110.597 175.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -74.37 -37.57 63.41 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.523 -0.762 . . . . 43.0 111.505 -179.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.55 HD22 ' HB3' ' A' ' 66' ' ' GLN . 48.8 mt -64.75 -33.43 75.96 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.662 0.785 . . . . 64.31 111.6 175.031 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.36 -25.03 62.2 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.716 -0.675 . . . . 74.34 110.275 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 26.0 m -79.85 -33.76 39.91 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 109.05 -0.722 . . . . 63.51 109.05 176.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -64.67 -50.57 66.52 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.285 0.634 . . . . 74.42 111.08 175.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.519 ' HG3' ' HB2' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -68.16 -56.13 9.87 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.98 0.912 . . . . 75.25 110.431 -173.216 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 113' ' ' GLU . 66.9 mt -67.76 -11.96 59.54 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.679 0.792 . . . . 62.11 112.527 -173.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.07 -39.59 93.44 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.263 0.625 . . . . 60.22 110.386 173.273 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -94.26 -37.7 11.39 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.488 -0.778 . . . . 71.21 110.516 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.55 160.33 26.92 Favored Glycine 0 C--N 1.349 1.295 0 N-CA-C 114.243 0.457 . . . . 41.11 114.243 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.472 ' HA ' HD23 ' A' ' 109' ' ' LEU . 0.2 OUTLIER -86.29 -16.98 35.82 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.429 1.092 . . . . 74.33 111.604 179.904 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -67.3 107.95 2.57 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.345 0.658 . . . . 51.24 111.262 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.583 HG23 ' HB3' ' A' ' 63' ' ' LEU . 2.9 p -73.71 -34.07 39.98 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 CA-C-N 115.459 -0.791 . . . . 74.2 109.91 170.164 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.56 HG12 HG13 ' A' ' 115' ' ' VAL . 22.4 mm -105.52 69.18 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.552 0.741 . . . . 73.22 110.306 -178.099 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 73.6 m 62.72 157.15 0.06 Allowed 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 125.428 1.491 . . . . 55.5 114.75 173.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -159.23 11.35 0.14 Allowed 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.606 0.965 . . . . 72.21 113.606 -178.883 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.561 1.369 0 N-CA-C 109.419 -0.585 . . . . 73.14 109.419 176.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.483 1.182 0 N-CA-C 109.807 -0.442 . . . . 73.44 109.807 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -116.71 -82.55 0.94 Allowed Glycine 0 C--N 1.342 0.891 0 N-CA-C 111.626 -0.589 . . . . 62.0 111.626 178.599 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.1 m80 57.35 23.13 8.55 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.49 1.116 . . . . 71.22 113.156 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -113.44 78.54 1.15 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 122.215 1.007 . . . . 53.33 109.624 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 43.1 t60 -125.31 88.09 2.81 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 107.539 -1.282 . . . . 64.44 107.539 177.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -106.36 112.11 24.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.71 -0.677 . . . . 72.1 110.847 -170.265 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.8 m-70 -131.15 118.85 21.07 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.361 1.064 . . . . 53.44 108.349 171.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -130.9 58.99 1.68 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 107.801 -1.185 . . . . 51.23 107.801 177.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.7 m -121.84 92.75 3.8 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 114.909 -1.041 . . . . 60.44 109.568 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.3 m-70 -133.2 84.5 2.14 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 108.203 -1.036 . . . . 60.14 108.203 178.168 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 94.4 mmm -73.21 82.67 1.34 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.36 -0.608 . . . . 74.32 109.36 176.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -98.77 105.95 18.15 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.69 -0.686 . . . . 73.3 109.297 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.5 p -168.02 125.83 1.16 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 124.0 0.92 . . . . 65.11 109.202 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -160.66 115.08 2.15 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.714 0.806 . . . . 75.03 109.019 175.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.69 167.53 12.45 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.967 0.907 . . . . 72.2 109.731 -176.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -137.1 139.94 41.6 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 108.007 -1.108 . . . . 74.52 108.007 168.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.58 HG21 ' HB2' ' A' ' 109' ' ' LEU . 1.6 mp -73.67 93.09 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 107.328 -1.36 . . . . 64.12 107.328 176.617 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -67.65 131.73 46.15 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.284 -0.871 . . . . 73.32 109.224 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.559 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.7 mm -112.78 124.9 69.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 N-CA-C 105.975 -1.861 . . . . 61.21 105.975 -178.93 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HD3' HD23 ' A' ' 33' ' ' LEU . 51.3 tttp -90.75 159.7 16.19 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.318 -1.364 . . . . 71.25 107.318 -179.097 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.499 HG21 ' HE3' ' A' ' 98' ' ' LYS . 41.2 m -137.83 133.17 33.63 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.893 -0.78 . . . . 75.52 108.893 176.882 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.541 HD11 HD22 ' A' ' 33' ' ' LEU . 50.6 mt -117.48 139.23 51.2 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 107.474 -1.306 . . . . 51.44 107.474 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 62.5 p -69.98 155.79 40.06 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 122.64 0.376 . . . . 61.33 110.296 175.271 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.0 p -131.35 149.53 73.86 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 124.31 1.044 . . . . 61.32 108.94 -177.337 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.3 -9.61 26.31 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 122.538 2.158 . . . . 55.32 113.308 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.411 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 21.3 t-20 -101.02 128.33 47.1 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.42 0.688 . . . . 71.15 109.446 174.824 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -68.0 -35.87 79.04 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.544 1.137 . . . . 73.02 113.315 -175.679 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -78.43 -16.01 58.04 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.993 0.517 . . . . 62.24 111.111 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.437 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -102.23 151.44 22.21 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.823 0.849 . . . . 51.11 110.155 -178.189 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.9 tp -160.74 118.82 2.49 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 108.112 -1.07 . . . . 72.33 108.112 172.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -90.69 130.91 36.64 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 121.489 0.662 . . . . 53.53 110.531 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -104.13 119.62 39.35 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 107.249 -1.389 . . . . 74.52 107.249 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.541 HD22 HD11 ' A' ' 22' ' ' LEU . 23.6 tp -98.54 123.47 42.73 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.517 -0.92 . . . . 73.02 108.517 -172.228 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.4 m -90.53 105.78 18.05 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 108.47 -0.937 . . . . 73.45 108.47 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.5 t -136.83 8.06 3.0 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 115.745 -0.661 . . . . 70.53 111.416 -174.199 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -145.63 141.25 27.98 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.146 -1.057 . . . . 74.32 108.146 175.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.564 ' HA3' HG13 ' A' ' 17' ' ' ILE . . . 81.91 -90.05 1.45 Allowed Glycine 0 C--N 1.34 0.79 0 N-CA-C 110.816 -0.914 . . . . 65.54 110.816 -173.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -134.26 -179.59 5.66 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.128 0.971 . . . . 63.31 109.958 178.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 12.3 ptp -111.88 162.14 15.62 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.128 0.971 . . . . 70.34 108.422 161.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.418 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 74.4 mt -70.66 -38.71 73.83 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.783 0.833 . . . . 64.41 111.731 -175.05 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.728 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.6 tt0 -148.48 140.84 24.23 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.735 -1.209 . . . . 75.32 107.735 -178.161 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 m -60.22 107.69 0.68 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.617 0.767 . . . . 52.34 110.65 -176.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.499 ' HA ' ' HB3' ' A' ' 81' ' ' ASP . 11.9 ttp180 -55.58 107.58 0.35 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.892 0.877 . . . . 65.54 112.388 -167.467 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 165.01 -8.38 0.07 OUTLIER Glycine 0 C--N 1.338 0.673 0 CA-C-N 114.56 -1.2 . . . . 74.34 113.194 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.6 t -103.44 -168.57 1.52 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.679 0.792 . . . . 73.23 110.064 176.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.4 178.61 5.56 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.597 1.159 . . . . 72.11 111.513 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 55.2 m -91.79 128.91 37.8 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.892 0.877 . . . . 53.45 109.818 173.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 mp -96.74 119.52 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 124.197 0.999 . . . . 75.24 109.016 -178.69 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -91.49 110.33 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 CA-C-N 118.447 0.567 . . . . 73.32 109.786 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.518 HD11 HD11 ' A' ' 116' ' ' ILE . 67.1 mt -101.95 109.74 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.46 1.104 . . . . 74.23 108.81 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -93.12 151.05 20.09 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.214 0.606 . . . . 73.5 109.882 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.469 ' HA ' HD11 ' A' ' 58' ' ' ILE . 47.3 p30 -66.95 -24.32 66.06 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.387 0.675 . . . . 73.54 112.137 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.8 t -84.52 -7.07 59.39 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.975 0.91 . . . . 60.02 112.008 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -111.66 88.7 2.86 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.272 0.629 . . . . 73.24 109.795 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.44 -35.26 51.85 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.273 1.029 . . . . 75.21 111.653 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -57.3 -53.39 58.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.511 1.124 . . . . 74.24 111.094 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.8 -34.41 78.28 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.417 -0.81 . . . . 71.2 111.231 -176.721 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.517 HG22 ' HG2' ' A' ' 65' ' ' GLN . 66.6 mt -70.09 -47.33 68.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.188 0.995 . . . . 74.03 110.217 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -62.29 -19.33 63.15 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.473 1.109 . . . . 53.43 112.683 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 64.0 t60 -69.25 -54.86 12.56 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-O 121.334 0.587 . . . . 74.33 109.732 172.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.3 m -94.67 107.82 19.81 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.103 -0.953 . . . . 72.22 110.478 -172.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 38.7 ttpt -59.1 -33.27 70.63 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.018 0.527 . . . . 73.24 109.741 174.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.417 HD11 HD12 ' A' ' 105' ' ' LEU . 30.6 tp -59.23 -46.52 88.25 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.619 1.167 . . . . 71.22 110.637 177.085 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.09 -47.02 84.49 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 123.85 0.86 . . . . 55.44 110.658 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.517 ' HG2' HG22 ' A' ' 58' ' ' ILE . 65.9 mt-30 -59.1 -39.94 83.77 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 124.58 1.175 . . . . 74.21 110.967 -178.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.547 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 87.3 mm-40 -66.73 -45.77 77.59 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 118.513 -0.756 . . . . 63.13 110.891 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -58.33 -43.61 86.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 CA-C-N 118.63 0.65 . . . . 63.13 110.68 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -68.58 -32.79 72.95 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.387 0.675 . . . . 74.41 111.342 175.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.6 tp -68.16 -34.8 76.99 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.439 0.696 . . . . 74.2 110.817 175.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.547 ' HG2' ' O ' ' A' ' 66' ' ' GLN . 7.1 mm100 -75.16 -41.31 58.4 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 120.983 0.421 . . . . 75.34 110.007 -178.77 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 61.0 m -151.43 100.57 2.97 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 124.136 0.974 . . . . 53.34 108.503 -176.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -67.25 1.95 2.61 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 123.381 2.721 . . . . 74.13 114.349 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.58 -5.42 89.92 Favored Glycine 0 C--N 1.352 1.457 0 CA-C-O 119.749 -0.473 . . . . 71.45 113.544 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.1 t -74.09 127.04 35.69 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 123.063 0.545 . . . . 74.45 110.243 177.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -84.79 -45.5 12.3 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.934 0.894 . . . . 54.32 110.874 -177.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.9 p -156.92 166.2 34.02 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.789 0.804 . . . . 71.04 110.923 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.1 mt -126.18 127.62 45.98 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 107.157 -1.423 . . . . 74.13 107.157 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.615 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.3 ttm -103.56 96.75 6.94 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 106.989 -1.485 . . . . 71.01 106.989 173.516 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 29.4 mm -77.88 101.01 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 114.893 -1.049 . . . . 51.4 108.685 -175.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.88 174.24 44.07 Favored Glycine 0 C--O 1.247 0.967 0 N-CA-C 110.31 -1.116 . . . . 64.14 110.31 176.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.728 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 2.5 m-20 -76.64 -56.67 4.4 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.791 0.805 . . . . 55.22 109.808 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -101.9 -7.79 22.15 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.474 -1.239 . . . . 65.13 111.114 -174.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -139.9 172.32 12.94 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.452 0.701 . . . . 74.55 110.654 -176.313 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.418 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 35.7 tp -143.75 106.93 4.52 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.872 0.469 . . . . 75.22 110.13 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.615 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 61.0 m -95.8 103.49 15.38 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.851 -0.796 . . . . 65.13 108.851 -176.346 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.632 HG13 HD13 ' A' ' 101' ' ' ILE . 15.7 mm -87.88 122.55 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.554 -0.906 . . . . 72.01 108.554 -177.101 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -108.35 113.57 26.75 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 108.153 -1.054 . . . . 74.13 108.153 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.74 177.55 5.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.45 0.7 . . . . 74.43 110.446 -175.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -77.16 136.85 38.61 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.184 0.593 . . . . 75.03 110.109 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -67.74 -22.18 65.24 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 112.86 0.689 . . . . 70.44 112.86 -171.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 71.8 mtm -79.81 -22.89 42.51 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.866 0.466 . . . . 54.15 110.888 176.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 38.5 t -89.56 141.72 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.028 -1.101 . . . . 73.54 108.028 176.681 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 68.7 m80 -110.9 157.24 20.09 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.612 0.597 . . . . 74.32 112.612 -171.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -70.74 -25.22 62.83 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.19 0.996 . . . . 71.24 112.93 -176.423 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -59.2 -24.87 63.48 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 120.977 0.417 . . . . 71.52 111.043 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 17.8 m -88.87 -42.29 11.94 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.283 1.033 . . . . 74.35 111.739 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.517 HG22 HD11 ' A' ' 101' ' ' ILE . 7.6 mt -91.33 -50.02 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 122.905 0.482 . . . . 72.34 111.039 -165.602 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.499 ' HE3' HG21 ' A' ' 21' ' ' THR . 85.8 tttt -50.95 -51.36 67.96 Favored Pre-proline 0 CA--C 1.566 1.561 0 N-CA-C 114.509 1.3 . . . . 74.31 114.509 -174.526 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -57.26 -35.15 98.85 Favored 'Trans proline' 0 C--N 1.398 3.143 0 C-N-CA 121.884 1.723 . . . . 73.52 112.147 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.427 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 26.0 mm-40 -67.53 -46.02 74.01 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.159 -0.928 . . . . 73.24 110.268 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.632 HD13 HG13 ' A' ' 86' ' ' ILE . 76.7 mt -61.53 -47.11 94.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.611 0.764 . . . . 50.35 110.565 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.559 HG23 ' HB ' ' A' ' 19' ' ' ILE . 76.8 mt -57.86 -45.55 87.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 123.659 0.599 . . . . 74.41 110.25 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -59.37 -48.0 83.3 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.851 0.86 . . . . 74.3 111.273 178.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 95.7 mt -62.88 -40.0 96.18 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.033 0.933 . . . . 73.31 111.726 -178.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.417 HD12 HD11 ' A' ' 63' ' ' LEU . 9.4 mp -71.74 -27.9 63.31 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.758 0.823 . . . . 70.4 110.933 178.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 97.5 m -74.25 -47.01 37.89 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.922 0.489 . . . . 74.34 109.775 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -76.15 -34.6 59.4 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.399 -0.819 . . . . 73.32 111.357 -174.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.665 ' HG3' ' HB2' ' A' ' 113' ' ' GLU . 30.8 tt0 -59.31 -55.34 36.09 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.92 0.488 . . . . 63.15 109.997 175.877 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.58 ' HB2' HG21 ' A' ' 17' ' ' ILE . 80.9 mt -73.43 -16.95 61.3 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.299 -0.864 . . . . 65.32 111.119 -175.266 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.35 -46.3 70.51 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.347 0.659 . . . . 72.04 110.407 171.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.499 ' HB2' ' HG3' ' A' ' 113' ' ' GLU . 18.8 m-85 -73.79 -19.22 60.83 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 115.963 -0.562 . . . . 73.02 110.155 173.678 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.57 44.4 26.7 Favored Glycine 0 C--N 1.35 1.358 0 N-CA-C 111.584 -0.607 . . . . 74.34 111.584 -179.084 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.665 ' HB2' ' HG3' ' A' ' 108' ' ' GLN . 44.0 mt-10 -88.69 174.9 7.76 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.747 0.819 . . . . 55.32 111.25 -177.667 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -109.85 128.21 55.19 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 124.685 1.194 . . . . 73.41 108.928 -178.321 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 5.1 p -75.93 -53.69 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 N-CA-C 107.591 -1.262 . . . . 71.24 107.591 165.378 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.518 HD11 HD11 ' A' ' 50' ' ' ILE . 30.7 mm -125.37 120.76 58.82 Favored 'Isoleucine or valine' 0 C--N 1.346 0.45 0 N-CA-C 106.207 -1.775 . . . . 61.35 106.207 167.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t -80.65 -177.86 6.48 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.033 0.933 . . . . 60.15 111.04 -175.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.7 15.49 3.18 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 124.766 1.226 . . . . 55.31 111.245 171.612 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 . . . . . 0 CA--C 1.556 1.176 0 C-N-CA 124.321 1.049 . . . . 74.04 109.842 177.803 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 109.12 -0.696 . . . . 72.35 109.12 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 136.59 121.98 2.11 Favored Glycine 0 C--N 1.349 1.261 0 O-C-N 123.514 0.509 . . . . 72.24 112.223 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -158.56 103.16 1.74 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.649 0.78 . . . . 73.24 109.943 175.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 26.0 t60 -144.17 93.65 2.47 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 108.742 -0.836 . . . . 64.13 108.742 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 -122.93 108.68 13.22 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.78 0.832 . . . . 72.43 109.248 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.8 m-70 -136.08 62.87 1.61 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.953 0.901 . . . . 65.41 109.3 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -95.45 135.67 36.8 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.197 -0.911 . . . . 71.01 109.501 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -128.93 137.21 51.27 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.399 0.679 . . . . 71.33 109.831 -178.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.4 t -167.09 123.45 1.16 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.958 0.503 . . . . 71.33 110.191 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -156.78 136.71 12.58 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.667 0.787 . . . . 72.54 109.73 174.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.0 ttp -153.55 98.26 2.21 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 108.598 -0.889 . . . . 74.32 108.598 177.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -151.22 117.26 5.56 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.277 0.631 . . . . 44.53 109.421 -175.029 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.1 m -139.44 92.94 2.62 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.46 0.704 . . . . 73.33 109.598 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -88.94 119.86 29.84 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.564 0.745 . . . . 63.11 109.972 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.514 ' HA ' ' NE ' ' A' ' 15' ' ' ARG . 2.2 mmp_? -103.56 119.81 39.62 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.804 0.841 . . . . 71.54 109.175 173.341 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.538 ' H ' HD23 ' A' ' 16' ' ' LEU . 2.3 pt? -121.82 126.2 48.23 Favored 'General case' 0 C--O 1.243 0.712 0 N-CA-C 107.646 -1.242 . . . . 74.5 107.646 177.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.415 ' O ' HG12 ' A' ' 19' ' ' ILE . 67.6 mt -73.05 135.14 28.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 107.357 -1.349 . . . . 74.51 107.357 172.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -67.51 105.42 1.83 Allowed 'General case' 0 C--O 1.241 0.644 0 CA-C-O 121.494 0.664 . . . . 75.32 110.25 -171.613 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 17' ' ' ILE . 49.8 mm -118.79 109.95 28.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 N-CA-C 106.378 -1.712 . . . . 74.2 106.378 -176.826 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -92.87 119.48 32.23 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 108.678 -0.86 . . . . 74.51 108.678 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.9 t -92.55 118.79 31.37 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.734 -0.839 . . . . 62.22 108.734 -178.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.4 mt -124.58 140.7 52.7 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.331 1.052 . . . . 71.33 109.19 -173.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 17.9 p -82.09 152.96 26.33 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 122.77 0.428 . . . . 70.4 110.595 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.7 p -114.4 169.94 6.01 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.119 0.968 . . . . 63.13 108.645 -178.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -59.63 -12.22 16.92 Favored 'Trans proline' 0 C--N 1.381 2.252 0 C-N-CA 122.487 2.124 . . . . 62.21 113.598 168.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.494 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 84.0 m-20 -95.0 151.49 19.12 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.203 1.001 . . . . 64.41 110.701 176.54 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -82.86 -45.26 14.46 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.265 0.626 . . . . 71.13 109.966 174.368 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -92.52 29.95 1.62 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.067 0.947 . . . . 64.22 111.048 -174.808 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -139.45 127.6 22.49 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.9 0.88 . . . . 74.53 108.769 171.213 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.9 tp -129.1 125.64 37.61 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.869 -1.159 . . . . 70.33 107.869 174.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -82.62 133.05 35.18 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.094 0.958 . . . . 73.51 110.588 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -117.01 122.96 45.71 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 107.885 -1.154 . . . . 73.21 107.885 171.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.7 tp -118.31 130.56 56.1 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.422 0.689 . . . . 73.0 111.099 -169.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 p -90.11 120.95 31.73 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 108.538 -0.912 . . . . 73.24 108.538 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 60.0 p -108.9 -26.95 9.97 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 113.669 0.988 . . . . 75.21 113.669 -164.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -72.32 -37.65 68.86 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 118.113 0.415 . . . . 74.41 110.599 -175.045 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 157.18 1.24 0.1 OUTLIER Glycine 0 C--N 1.345 1.037 0 CA-C-O 119.514 -0.604 . . . . 34.32 114.218 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.524 ' HB3' HD22 ' A' ' 109' ' ' LEU . 18.6 mp0 -79.77 84.84 5.51 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.365 0.666 . . . . 74.3 110.879 -171.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 79.7 mtp -77.72 124.81 28.43 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.118 0.485 . . . . 75.01 110.457 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.585 ' HB3' HG12 ' A' ' 115' ' ' VAL . 95.6 mt -65.64 -33.23 75.41 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 125.142 1.377 . . . . 71.11 112.209 -177.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.576 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 29.1 tt0 -147.73 153.75 39.67 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.81 1.244 . . . . 74.11 107.76 -174.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 5.0 t -75.78 129.09 36.49 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.246 0.218 . . . . 72.32 110.55 -174.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -51.29 97.83 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.439 1.495 . . . . 75.24 110.988 179.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 143.61 -20.77 2.2 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 116.066 -0.515 . . . . 72.53 112.286 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 63.8 m -85.91 125.7 33.53 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.412 0.685 . . . . 54.41 109.157 174.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -62.12 145.88 52.08 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.014 0.526 . . . . 74.33 111.665 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.1 m -63.05 113.09 2.91 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.107 0.963 . . . . 73.21 111.441 -174.248 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.6 mt -80.85 116.1 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 123.607 0.763 . . . . 70.22 110.365 -174.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 64.4 t -91.55 108.26 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 N-CA-C 109.082 -0.71 . . . . 64.44 109.082 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.416 ' HB ' ' HB2' ' A' ' 77' ' ' LEU . 73.3 mt -96.45 110.28 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 108.066 -1.087 . . . . 63.43 108.066 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.4 mtmp? -92.52 161.66 14.53 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.869 0.467 . . . . 74.05 110.279 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.9 p30 -65.58 -25.82 67.57 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 113.736 1.013 . . . . 74.11 113.736 -175.059 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.0 p -84.9 -12.1 54.15 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.384 0.274 . . . . 62.04 111.462 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -82.89 68.97 9.59 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.32 0.648 . . . . 73.45 110.043 -177.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -49.26 -39.33 30.09 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.504 1.522 . . . . 71.22 111.648 176.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 39.6 t-20 -60.23 -50.13 74.89 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.568 1.147 . . . . 63.15 110.568 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 71.2 mt -74.73 -28.93 60.99 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.855 0.462 . . . . 55.1 111.559 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 82.8 mt -67.14 -49.2 75.19 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 N-CA-C 109.224 -0.658 . . . . 61.11 109.224 174.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -66.54 -24.42 66.37 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.121 0.415 . . . . 63.52 112.121 177.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -79.77 -24.74 41.31 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 112.022 0.379 . . . . 60.52 112.022 175.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.9 t -114.97 108.52 16.81 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 109.747 -0.464 . . . . 73.43 109.747 177.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -64.54 -31.64 72.94 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.057 0.543 . . . . 63.15 110.778 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.524 ' HB2' ' NE2' ' A' ' 108' ' ' GLN . 58.6 tp -60.74 -41.63 95.77 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.517 0.727 . . . . 72.13 110.599 173.578 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -57.65 -47.39 82.4 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.837 0.455 . . . . 42.52 110.459 177.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -59.17 -44.77 92.16 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.077 -0.965 . . . . 70.23 110.571 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -59.75 -53.33 59.22 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.811 0.844 . . . . 71.12 112.488 177.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.689 HG22 HG21 ' A' ' 74' ' ' VAL . 59.6 mt -65.51 -39.82 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 123.084 0.554 . . . . 63.25 111.143 -174.645 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -66.78 -31.03 71.4 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.337 0.655 . . . . 74.14 111.51 174.367 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.3 tp -70.85 -52.78 18.22 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.872 0.469 . . . . 72.35 110.744 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -69.79 -29.23 66.49 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.321 -0.854 . . . . 74.21 110.894 -174.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.628 ' SG ' HG23 ' A' ' 97' ' ' ILE . 82.3 m -144.61 96.33 5.2 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 108.884 -0.784 . . . . 54.25 108.884 176.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -63.87 -4.57 7.54 Favored 'Trans proline' 0 N--CA 1.5 1.911 0 C-N-CA 123.276 2.651 . . . . 73.24 114.315 175.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.523 ' HA3' HG21 ' A' ' 92' ' ' VAL . . . -86.99 8.64 75.56 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-O 119.555 -0.581 . . . . 70.23 113.794 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.689 HG21 HG22 ' A' ' 67' ' ' ILE . 99.9 t -69.79 124.74 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.192 0.597 . . . . 64.31 110.073 173.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.05 -56.6 3.39 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.905 -0.776 . . . . 72.5 108.905 -179.086 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 61.1 m -147.74 167.92 23.43 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 115.768 -0.651 . . . . 61.32 110.891 -178.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.416 ' HB2' ' HB ' ' A' ' 50' ' ' ILE . 77.3 mt -127.16 148.54 50.17 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.535 1.134 . . . . 71.55 109.097 176.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.539 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.0 ttm -126.17 111.02 14.13 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 108.051 -1.092 . . . . 54.55 108.051 169.094 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.0 mm -89.35 103.01 13.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 108.37 -0.974 . . . . 71.44 108.37 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.9 176.81 41.22 Favored Glycine 0 C--O 1.243 0.671 0 N-CA-C 111.5 -0.64 . . . . 75.14 111.5 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.576 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 3.9 m-20 -69.96 -60.28 2.4 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.737 0.779 . . . . 61.41 109.611 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.23 -17.28 14.52 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.82 -1.082 . . . . 72.04 110.302 -177.648 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -118.63 167.99 11.12 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.363 0.665 . . . . 73.03 111.556 -171.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 31.8 tp -141.3 142.59 33.85 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.512 0.725 . . . . 75.44 109.326 175.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.539 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 86.8 m -131.03 118.15 20.17 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.289 0.636 . . . . 64.12 109.685 174.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 19.7 mm -108.77 108.17 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 109.922 -0.399 . . . . 63.25 109.922 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -83.15 146.62 28.54 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.382 0.673 . . . . 71.21 110.53 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.776 ' HE2' HG21 ' A' ' 97' ' ' ILE . 34.6 mmtm -123.51 171.59 9.39 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.893 0.877 . . . . 72.01 110.322 173.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.65 149.13 32.94 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.891 -1.151 . . . . 62.43 107.891 163.301 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -62.79 -24.44 67.74 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.432 0.693 . . . . 73.23 112.599 -175.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 21.5 ptm -73.13 -18.79 61.25 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.059 0.544 . . . . 50.4 111.822 -177.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.523 HG21 ' HA3' ' A' ' 73' ' ' GLY . 8.5 t -100.98 137.14 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.64 0.776 . . . . 63.2 109.811 -175.085 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -97.76 148.52 23.28 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.541 0.736 . . . . 73.14 111.733 -174.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -74.41 -36.43 63.47 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.941 1.296 . . . . 75.53 113.306 -173.693 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -52.57 -29.04 23.58 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.333 1.053 . . . . 60.5 113.241 -173.325 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.7 p -83.07 -36.51 24.84 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.399 0.68 . . . . 74.33 110.676 -178.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.776 HG21 ' HE2' ' A' ' 88' ' ' LYS . 48.2 mt -89.6 -29.53 5.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 CA-C-N 115.118 -0.946 . . . . 72.14 112.196 -164.198 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -53.3 -53.43 56.23 Favored Pre-proline 0 CA--C 1.562 1.426 0 CA-C-O 117.766 -1.111 . . . . 72.42 112.546 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.87 -31.94 94.56 Favored 'Trans proline' 0 C--N 1.395 3.015 0 C-N-CA 121.927 1.752 . . . . 72.45 112.51 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -64.01 -52.75 58.06 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.37 0.419 . . . . 71.44 111.272 177.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 67.5 mt -66.58 -43.7 90.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 122.989 0.515 . . . . 73.45 110.828 -176.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 93.5 mt -58.54 -40.41 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 122.89 0.476 . . . . 64.32 110.49 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.17 -46.99 75.45 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 123.326 0.391 . . . . 71.43 111.046 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.1 mt -62.31 -34.88 77.46 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.526 0.73 . . . . 73.42 111.469 -179.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.66 -35.43 70.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.46 0.704 . . . . 72.22 110.555 175.622 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 17' ' ' ILE . 92.3 m -72.9 -32.75 65.57 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.638 -0.504 . . . . 64.52 109.638 179.632 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -66.7 -57.2 7.62 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.573 0.749 . . . . 72.2 110.129 174.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.524 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 26.2 tt0 -53.28 -55.58 23.5 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.062 0.945 . . . . 75.42 111.637 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 38' ' ' GLU . 76.8 mt -68.87 -15.85 63.61 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 124.162 0.914 . . . . 63.35 111.609 -174.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -80.34 -20.44 44.19 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.292 0.637 . . . . 50.24 111.628 175.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -100.93 -28.19 12.89 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.217 0.607 . . . . 74.02 110.664 175.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.14 140.96 3.66 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.898 -0.592 . . . . 65.44 111.805 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -59.69 -33.83 72.1 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.898 0.879 . . . . 74.53 111.857 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -75.77 133.52 40.68 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.344 0.592 . . . . 74.54 111.822 -173.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.585 HG12 ' HB3' ' A' ' 40' ' ' LEU . 3.1 p -87.0 -44.53 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 107.889 -1.152 . . . . 62.52 107.889 158.078 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 66.3 mt -134.23 120.26 33.66 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 124.914 1.286 . . . . 42.11 107.691 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.8 m -83.04 69.15 9.78 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 108.465 -0.939 . . . . 62.14 108.465 173.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -84.04 93.28 8.06 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.302 -0.863 . . . . 74.55 110.262 -177.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 . . . . . 0 C--O 1.25 1.101 0 N-CA-C 106.545 -1.65 . . . . 63.2 106.545 173.583 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.522 0.201 . . . . 72.53 110.575 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.95 39.04 0.03 OUTLIER Glycine 0 C--N 1.347 1.142 0 N-CA-C 112.148 -0.381 . . . . 63.45 112.148 178.806 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -94.3 63.7 3.09 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.81 0.814 . . . . 65.33 109.357 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 22.5 p-80 -85.32 105.3 15.88 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 114.878 -1.055 . . . . 43.14 111.113 -173.492 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.2 p-80 -154.71 112.89 3.5 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.227 0.611 . . . . 53.51 110.372 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -162.13 108.93 1.32 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.169 0.988 . . . . 74.54 109.032 174.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 12.4 p80 -163.75 73.77 0.3 Allowed 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.348 0.659 . . . . 72.14 111.078 -177.384 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.7 p-80 -163.68 20.31 0.07 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.193 0.597 . . . . 75.45 112.423 176.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.2 p -90.34 113.39 25.25 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.706 0.403 . . . . 74.4 110.202 176.171 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 -119.61 141.62 49.14 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.705 0.802 . . . . 63.11 109.716 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -140.67 103.78 4.59 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.312 0.577 . . . . 63.21 110.716 -176.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -126.25 116.52 21.4 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.12 0.968 . . . . 65.12 108.963 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.6 t -137.51 92.27 2.68 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 109.094 -0.706 . . . . 44.03 109.094 177.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -90.54 156.37 18.21 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.593 0.757 . . . . 71.3 110.072 177.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.439 HH22 ' HB2' ' A' ' 36' ' ' ASP . 2.4 ptm180 -139.2 168.26 20.22 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.59 0.756 . . . . 55.32 110.54 177.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.4 mt -122.87 175.65 6.43 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.541 0.737 . . . . 74.21 110.118 170.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.532 ' HB ' HG23 ' A' ' 106' ' ' THR . 93.0 mt -123.18 105.04 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.097 0.959 . . . . 64.31 109.745 -176.324 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -84.67 135.46 34.15 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.1 0.56 . . . . 63.2 110.028 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.54 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.7 mm -128.78 122.23 56.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 107.522 -1.288 . . . . 60.41 107.522 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -101.6 125.44 48.26 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.288 1.035 . . . . 72.22 108.629 -176.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' THR . . . . . 0.545 HG21 ' HE3' ' A' ' 98' ' ' LYS . 28.8 m -105.53 111.22 23.84 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.594 -0.891 . . . . 64.43 108.594 -179.189 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.0 mt -100.43 139.35 36.23 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.966 0.906 . . . . 73.12 111.112 -174.514 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.2 p -70.48 130.4 41.77 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 124.372 1.045 . . . . 64.13 110.165 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 43.5 p -118.21 152.76 51.03 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 123.177 0.591 . . . . 63.31 110.185 -174.62 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.86 8.33 3.49 Favored 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 122.911 2.407 . . . . 64.45 112.615 172.299 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -90.42 123.57 34.25 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.333 1.053 . . . . 73.42 109.073 -178.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.509 ' HG2' HD22 ' A' ' 28' ' ' ASN . 45.5 tt0 -77.87 130.77 37.04 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.399 0.68 . . . . 74.24 110.731 -177.621 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.509 HD22 ' HG2' ' A' ' 27' ' ' GLU . 51.2 m-80 59.1 25.11 13.51 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.637 1.175 . . . . 71.15 112.263 -173.718 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.507 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -142.02 139.48 32.37 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.382 0.673 . . . . 72.11 109.686 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.4 tp -148.34 138.04 22.25 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.733 0.413 . . . . 72.31 110.555 -173.324 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -85.9 123.78 31.63 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.374 0.669 . . . . 75.22 111.814 -174.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -110.34 110.6 21.45 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 107.174 -1.417 . . . . 51.41 107.174 170.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.3 tp -106.08 129.62 54.14 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.331 1.052 . . . . 70.45 110.24 -167.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.9 m -77.51 104.99 8.36 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.995 -0.743 . . . . 72.12 108.995 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.5 p -113.09 10.56 18.73 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.552 0.741 . . . . 64.25 111.278 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.439 ' HB2' HH22 ' A' ' 15' ' ' ARG . 6.2 p-10 -75.34 -26.7 58.8 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.379 0.672 . . . . 64.44 110.902 -179.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.71 -36.96 1.92 Allowed Glycine 0 C--N 1.334 0.419 0 N-CA-C 110.395 -1.082 . . . . 70.43 110.395 -176.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -78.2 161.41 27.34 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 122.026 0.917 . . . . 74.04 111.446 174.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.447 ' HE1' ' HG2' ' A' ' 43' ' ' ARG . 85.0 mtp -117.97 142.53 47.26 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 106.376 -1.713 . . . . 62.33 106.376 170.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 82.5 mt -55.29 -45.22 76.24 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.842 0.457 . . . . 71.04 112.021 -175.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.612 ' NE2' ' HB ' ' A' ' 116' ' ' ILE . 33.2 tt0 -133.74 145.55 49.94 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.333 1.053 . . . . 75.25 108.789 -177.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 9.4 m -64.35 146.57 54.22 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.086 0.554 . . . . 43.14 109.899 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.447 ' HG2' ' HE1' ' A' ' 39' ' ' MET . 99.5 mtt180 -58.5 -5.04 0.47 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 116.359 1.985 . . . . 71.13 116.359 -161.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -87.2 54.28 4.5 Favored Glycine 0 CA--C 1.533 1.176 0 N-CA-C 111.157 -0.777 . . . . 73.35 111.157 165.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.1 m -97.01 169.1 10.06 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.768 0.827 . . . . 75.4 111.009 -176.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -120.05 178.02 4.77 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 108.115 -1.069 . . . . 53.23 108.115 168.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.1 p -87.87 71.8 9.44 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.603 -1.258 . . . . 64.34 107.603 167.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.568 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 55.9 mt -72.42 104.49 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 115.323 -0.853 . . . . 51.21 109.817 -167.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 77' ' ' LEU . 60.2 t -87.63 109.59 19.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.806 -0.813 . . . . 53.04 108.806 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.461 HD11 HD11 ' A' ' 116' ' ' ILE . 52.5 mt -109.41 112.37 40.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 108.674 -0.862 . . . . 71.12 108.674 178.522 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.5 mtpt -86.47 162.01 18.31 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 109.39 -0.596 . . . . 73.42 109.39 173.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.8 p-10 -59.06 -24.75 63.15 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.41 1.084 . . . . 72.24 112.332 178.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.1 t -81.63 -18.23 45.39 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.073 0.549 . . . . 52.13 111.196 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.0 68.28 7.23 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.971 0.908 . . . . 73.22 111.115 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -60.02 -27.27 66.76 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.453 0.701 . . . . 73.32 110.994 176.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -60.37 -40.21 90.02 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 122.927 0.491 . . . . 72.12 111.355 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.442 ' HB2' HG23 ' A' ' 50' ' ' ILE . 87.1 mt -81.24 -35.7 30.88 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.808 0.843 . . . . 60.1 111.748 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 83.0 mt -63.22 -35.09 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.771 0.828 . . . . 44.4 109.836 176.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -63.02 -28.1 69.87 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.755 1.222 . . . . 42.15 111.663 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -82.02 -7.35 59.61 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.48 0.712 . . . . 72.31 111.926 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.481 ' HB2' HG12 ' A' ' 116' ' ' ILE . 39.2 t -135.74 101.77 4.87 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.895 0.478 . . . . 73.33 111.013 -171.08 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -54.76 -36.32 64.73 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.241 0.616 . . . . 52.14 110.648 170.7 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.567 ' HB2' ' HG3' ' A' ' 108' ' ' GLN . 27.2 tp -63.61 -44.08 95.0 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.261 0.624 . . . . 73.02 111.155 177.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.03 98.07 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.901 0.48 . . . . 55.33 111.099 179.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -54.43 -48.41 71.69 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 124.144 0.902 . . . . 53.14 110.475 175.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.544 ' HB3' HD22 ' A' ' 104' ' ' LEU . 27.9 mm-40 -63.68 -41.08 98.2 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.167 0.987 . . . . 73.35 113.101 178.405 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.544 HG21 HD21 ' A' ' 77' ' ' LEU . 95.9 mt -64.68 -53.22 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.472 0.709 . . . . 72.34 111.164 -178.239 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -68.49 -27.75 66.4 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 123.415 0.447 . . . . 71.5 111.416 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -66.55 -58.58 4.9 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.182 0.593 . . . . 54.14 110.739 177.008 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.467 ' NE2' HD21 ' A' ' 104' ' ' LEU . 78.7 mt-30 -79.21 -26.59 42.55 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.765 -0.652 . . . . 62.05 112.139 -174.057 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 79.5 m -133.08 86.85 41.29 Favored Pre-proline 0 CA--C 1.548 0.891 0 N-CA-C 108.904 -0.776 . . . . 62.13 108.904 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.88 -7.08 19.56 Favored 'Trans proline' 0 C--N 1.369 1.641 0 C-N-CA 122.933 2.422 . . . . 65.23 112.644 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.23 -15.28 81.71 Favored Glycine 0 C--N 1.347 1.19 0 CA-C-N 116.221 -0.445 . . . . 65.14 113.138 178.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 68.0 t -73.39 121.8 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 108.683 -0.858 . . . . 52.1 108.683 174.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -90.95 -28.67 17.9 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 115.9 -0.591 . . . . 71.22 110.904 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.7 t -161.65 161.63 29.63 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.591 0.71 . . . . 73.04 111.536 -171.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.544 HD21 HG21 ' A' ' 67' ' ' ILE . 84.6 mt -126.06 150.94 47.78 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.734 1.214 . . . . 75.1 108.228 177.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.575 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.3 ttm -125.01 104.15 8.4 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.028 -1.471 . . . . 73.21 107.028 168.084 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.714 HD13 HD13 ' A' ' 84' ' ' LEU . 34.2 mm -86.82 132.76 31.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.524 -0.917 . . . . 72.24 108.524 -175.436 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -121.14 -170.58 14.05 Favored Glycine 0 C--O 1.245 0.834 0 N-CA-C 110.901 -0.88 . . . . 53.22 110.901 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.02 -55.06 16.05 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.04 0.924 . . . . 74.53 109.707 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -118.03 0.98 11.96 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.513 -1.221 . . . . 74.23 111.705 -172.066 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -140.52 166.26 25.21 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.351 0.596 . . . . 73.44 111.661 -170.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.714 HD13 HD13 ' A' ' 79' ' ' ILE . 17.3 tp -141.65 116.56 9.86 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 114.368 -1.287 . . . . 53.23 108.601 176.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.575 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 14.1 m -100.61 111.56 23.82 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.261 -1.015 . . . . 74.01 108.261 179.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 29' ' ' ALA . 43.2 mm -86.31 125.88 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 109.244 -0.65 . . . . 73.33 109.244 -174.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -110.57 118.7 36.94 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 107.976 -1.12 . . . . 65.45 107.976 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -130.37 170.86 13.6 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 120.953 0.406 . . . . 71.34 111.205 -174.075 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.417 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 16.6 t70 -71.7 148.99 45.89 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 115.092 -0.958 . . . . 74.33 110.638 174.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 18.1 ptp180 -62.69 -24.11 67.48 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.309 1.044 . . . . 74.02 113.03 -175.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 86.8 mtp -80.11 -14.75 58.26 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.847 0.459 . . . . 72.33 111.784 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.84 124.09 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.543 0.737 . . . . 62.0 109.262 -175.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -89.18 142.47 27.62 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.489 0.716 . . . . 62.55 110.749 -172.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -58.81 -33.75 70.73 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.832 0.853 . . . . 73.35 112.442 178.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -61.62 -23.59 66.14 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.206 0.602 . . . . 52.03 112.277 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 26.5 m -91.61 -17.89 24.86 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.463 0.705 . . . . 74.25 111.849 177.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 87.1 mt -96.29 -50.8 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.894 0.878 . . . . 74.23 111.198 -171.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.545 ' HE3' HG21 ' A' ' 21' ' ' THR . 57.7 mtpt -56.15 -57.51 22.0 Favored Pre-proline 0 CA--C 1.551 0.988 0 CA-C-O 117.436 -1.269 . . . . 74.33 113.565 -167.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -59.59 -36.51 92.4 Favored 'Trans proline' 0 C--N 1.395 2.999 0 C-N-CA 121.978 1.786 . . . . 60.12 111.842 -174.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 6.3 mm-40 -66.59 -49.83 65.05 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 114.917 -1.038 . . . . 65.44 110.928 -177.378 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 24.4 mt -75.48 -29.88 21.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 C-N-CA 123.209 0.604 . . . . 70.23 111.502 -175.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.54 HG23 ' HB ' ' A' ' 19' ' ' ILE . 93.7 mt -60.2 -42.54 90.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-O 121.108 0.48 . . . . 73.01 109.795 170.442 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -63.63 -40.06 95.92 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 114.926 -1.034 . . . . 72.41 110.852 176.39 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.544 HD22 ' HB3' ' A' ' 66' ' ' GLN . 98.5 mt -66.57 -38.37 86.91 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.622 0.769 . . . . 73.23 112.53 178.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.6 HD11 HD23 ' A' ' 84' ' ' LEU . 10.0 mp -65.38 -24.24 67.17 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.621 0.369 . . . . 41.44 110.802 174.575 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.532 HG23 ' HB ' ' A' ' 17' ' ' ILE . 89.2 m -81.69 -37.16 27.82 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.569 0.747 . . . . 72.05 109.612 177.258 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -63.21 -46.62 86.17 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.436 0.695 . . . . 70.1 111.138 175.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.567 ' HG3' ' HB2' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -64.09 -56.97 11.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.002 0.921 . . . . 65.11 110.3 -175.027 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.488 ' HB2' HD13 ' A' ' 17' ' ' ILE . 97.1 mt -68.54 -12.63 61.54 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 115.761 -0.654 . . . . 63.44 112.279 -176.292 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -88.06 -49.54 6.97 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.863 0.465 . . . . 74.44 111.268 174.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -92.49 -16.53 25.68 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.649 0.379 . . . . 75.13 111.855 -170.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -134.13 -135.66 3.57 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 110.893 -0.883 . . . . 41.05 110.893 -178.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -160.85 -60.18 0.06 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.613 0.765 . . . . 64.12 110.071 -175.594 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -92.44 141.9 28.02 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.738 0.815 . . . . 43.43 110.087 -178.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.505 HG21 HD12 ' A' ' 79' ' ' ILE . 6.0 p -71.44 -43.27 72.81 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 N-CA-C 108.573 -0.899 . . . . 64.11 108.573 168.109 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.612 ' HB ' ' NE2' ' A' ' 41' ' ' GLN . 83.3 mt -139.66 134.07 38.11 Favored 'Isoleucine or valine' 0 C--O 1.243 0.748 0 C-N-CA 124.957 1.303 . . . . 53.13 107.757 178.221 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 12.8 p -74.34 82.59 1.9 Allowed 'General case' 0 CA--C 1.549 0.929 0 CA-C-O 121.509 0.671 . . . . 74.42 109.395 171.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -81.17 77.65 8.04 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 107.772 -1.195 . . . . 63.54 107.772 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 . . . . . 0 C--O 1.246 0.903 0 N-CA-C 108.126 -1.065 . . . . 54.55 108.126 -170.547 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 109.978 -0.378 . . . . 74.33 109.978 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 155.9 109.53 0.31 Allowed Glycine 0 C--N 1.35 1.331 0 CA-C-O 119.863 -0.41 . . . . 74.02 112.875 177.244 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 67.1 m170 -121.38 112.17 18.22 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.008 0.923 . . . . 64.35 109.379 172.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 52.5 p-80 -170.75 144.11 2.23 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.088 0.955 . . . . 72.12 109.452 170.653 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -124.77 -172.68 2.62 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.618 0.767 . . . . 71.43 109.529 177.23 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 53.9 m80 -133.94 140.43 46.76 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.85 0.86 . . . . 73.15 109.219 177.729 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.5 m80 -88.38 121.09 30.38 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.675 0.79 . . . . 72.22 110.42 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 47.1 p-80 -91.47 130.21 37.34 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 109.006 -0.739 . . . . 73.44 109.006 172.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.3 p -150.23 113.52 4.9 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.657 0.783 . . . . 72.42 110.073 -176.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.08 147.1 25.46 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.264 0.626 . . . . 71.55 109.868 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 23.2 ptm -147.34 126.77 13.17 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 107.879 -1.156 . . . . 72.52 107.879 175.379 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -61.3 103.46 0.3 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.147 0.579 . . . . 62.41 109.605 -176.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.7 p -129.49 45.64 2.77 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.938 0.895 . . . . 60.45 111.218 -168.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -71.44 91.94 1.06 Allowed 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 109.376 -0.602 . . . . 74.34 109.376 173.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -73.8 152.95 40.15 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.88 0.872 . . . . 74.25 110.302 -177.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.457 ' H ' HD23 ' A' ' 16' ' ' LEU . 2.3 pt? -126.65 169.34 13.22 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.197 0.599 . . . . 74.1 110.524 -179.595 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.403 HG13 ' HB2' ' A' ' 109' ' ' LEU . 11.6 mm -79.58 123.18 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.024 0.93 . . . . 73.14 110.557 -166.611 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' HIS . . . . . 0.488 ' HB2' ' O ' ' A' ' 35' ' ' THR . 5.0 m170 -87.89 138.05 31.79 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 107.728 -1.212 . . . . 72.02 107.728 174.238 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.521 ' HB ' HG23 ' A' ' 102' ' ' ILE . 51.4 mm -123.06 116.45 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 107.848 -1.168 . . . . 62.5 107.848 -176.053 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.606 ' HE3' HD21 ' A' ' 22' ' ' LEU . 62.6 tttp -100.12 125.77 46.27 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.167 1.387 . . . . 72.24 108.955 -172.493 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 89.5 m -93.77 112.01 23.8 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.679 -0.86 . . . . 63.52 108.679 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.606 HD21 ' HE3' ' A' ' 20' ' ' LYS . 93.9 mt -106.31 136.59 45.77 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 123.737 0.815 . . . . 75.24 109.49 177.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 34.6 p -89.16 143.25 26.98 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.635 0.774 . . . . 71.42 110.405 179.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.7 p -119.98 154.24 55.42 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 124.377 1.071 . . . . 74.23 109.278 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -49.7 -45.97 29.27 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 123.571 2.847 . . . . 74.11 113.244 176.069 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -77.85 114.99 17.25 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.818 0.847 . . . . 71.25 109.145 175.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.38 -19.35 59.6 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.864 0.466 . . . . 50.33 111.436 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.9 m-80 -63.42 -27.18 69.12 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.914 0.886 . . . . 74.44 109.612 172.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.413 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -102.37 154.06 19.43 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.056 1.342 . . . . 75.42 110.94 176.442 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 tp -151.07 127.82 10.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.683 0.793 . . . . 70.15 108.884 170.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -90.17 138.19 31.73 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.326 0.65 . . . . 74.24 111.729 -174.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -123.49 126.25 46.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.699 1.2 . . . . 74.13 108.638 171.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.6 tp -117.05 125.72 51.76 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.269 1.027 . . . . 73.41 108.656 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.4 p -80.59 107.07 13.09 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 108.848 -0.797 . . . . 71.12 108.848 176.448 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.488 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 26.0 p -106.87 127.43 53.41 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.009 1.324 . . . . 71.52 108.638 -177.894 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 57.99 73.79 0.45 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.349 1.06 . . . . 75.43 109.943 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -175.82 -130.05 1.28 Allowed Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 114.277 -1.328 . . . . 34.24 110.474 -176.636 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -129.4 156.26 44.36 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.818 0.847 . . . . 73.2 109.753 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 15.7 ttt -78.4 144.99 35.4 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.489 0.716 . . . . 61.13 110.776 -171.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' A' ' 84' ' ' LEU . 96.3 mt -70.73 -39.27 73.47 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.52 0.728 . . . . 71.04 112.2 -175.345 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.544 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.9 tp-100 -147.83 149.94 33.25 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.949 0.899 . . . . 74.54 109.031 -176.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.427 HG22 ' H ' ' A' ' 44' ' ' GLY . 47.5 m -73.14 140.73 47.28 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.036 0.535 . . . . 74.34 110.154 176.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -63.66 -22.03 66.69 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.879 0.872 . . . . 72.52 112.266 -175.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLY . . . . . 0.427 ' H ' HG22 ' A' ' 42' ' ' THR . . . -64.61 -23.43 68.79 Favored Glycine 0 C--N 1.35 1.326 0 CA-C-O 120.046 -0.308 . . . . 74.35 113.713 176.021 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.7 m -90.15 166.68 13.25 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.785 0.834 . . . . 63.25 111.678 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -94.99 -172.95 2.83 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.217 1.007 . . . . 75.03 109.881 175.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.6 p -72.56 101.26 2.95 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.542 0.737 . . . . 73.34 110.189 174.316 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 53.9 mt -78.51 102.53 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.445 0.698 . . . . 73.15 109.72 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 40.5 t -90.19 108.71 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 N-CA-C 109.036 -0.728 . . . . 54.45 109.036 -176.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 72.2 mt -98.36 109.14 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 N-CA-C 108.593 -0.891 . . . . 61.44 108.593 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -103.55 141.01 36.75 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.0 0.52 . . . . 73.22 110.007 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -62.37 -23.84 67.03 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.846 0.858 . . . . 54.42 112.842 -175.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.3 t -69.6 -35.62 75.48 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.35 0.66 . . . . 73.5 110.763 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -97.13 77.24 2.7 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 107.755 -1.202 . . . . 75.21 107.755 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.551 ' HA ' HD13 ' A' ' 58' ' ' ILE . 36.8 tt0 -66.34 -15.68 63.46 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.486 -0.779 . . . . 73.02 112.138 -172.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -63.35 -38.02 89.52 Favored 'General case' 0 C--N 1.35 0.623 0 N-CA-C 110.09 -0.337 . . . . 71.55 110.09 173.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.09 -36.43 84.27 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.593 0.757 . . . . 65.41 110.419 177.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.551 HD13 ' HA ' ' A' ' 55' ' ' GLU . 1.9 mp -61.73 -50.1 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 CA-C-N 115.063 -0.972 . . . . 54.24 109.026 173.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -65.87 -24.62 66.9 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.596 0.758 . . . . 64.14 112.016 -176.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 29.1 m170 -72.94 -39.07 66.54 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.795 0.438 . . . . 74.32 110.251 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.489 ' HA ' ' HA ' ' A' ' 116' ' ' ILE . 34.5 m -106.93 112.86 26.02 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.499 0.72 . . . . 74.24 111.614 -172.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -55.98 -39.09 71.3 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.201 0.6 . . . . 54.24 111.268 177.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.641 HD11 HD12 ' A' ' 105' ' ' LEU . 21.4 tp -61.62 -40.04 93.44 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 123.718 0.637 . . . . 70.12 111.065 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.409 ' HA ' HD11 ' A' ' 77' ' ' LEU . . . -65.94 -42.97 89.33 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.071 0.548 . . . . 64.11 111.003 179.446 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -55.89 -50.69 69.97 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.259 0.624 . . . . 75.44 109.947 176.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.494 ' HB3' HD22 ' A' ' 104' ' ' LEU . 26.7 mm-40 -59.31 -50.66 73.15 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.441 1.096 . . . . 73.43 112.613 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.0 mt -66.85 -51.28 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.354 0.662 . . . . 72.14 111.475 -174.109 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -67.18 -29.99 69.83 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.038 0.535 . . . . 74.44 111.827 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -70.07 -59.53 2.84 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-O 120.883 0.373 . . . . 72.23 110.814 176.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -82.75 -10.51 58.86 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.578 0.751 . . . . 72.12 111.984 -170.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.485 ' SG ' HG12 ' A' ' 97' ' ' ILE . 44.4 t -145.49 84.08 8.64 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 108.696 -0.853 . . . . 65.45 108.696 169.393 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -69.91 2.64 3.44 Favored 'Trans proline' 0 C--N 1.381 2.278 0 C-N-CA 123.195 2.597 . . . . 53.11 113.817 179.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' GLY . . . . . 0.506 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -84.39 -1.44 89.35 Favored Glycine 0 C--N 1.349 1.259 0 N-CA-C 114.168 0.427 . . . . 72.01 114.168 176.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 89.3 t -85.45 132.07 32.74 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 123.211 0.604 . . . . 64.41 109.443 174.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -84.01 -50.31 8.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.561 1.144 . . . . 71.0 110.875 176.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.8 p -155.02 155.5 34.27 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.61 -0.723 . . . . 73.12 110.955 -174.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.409 HD11 ' HA ' ' A' ' 64' ' ' ALA . 36.3 mt -106.85 148.58 28.37 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.378 -1.341 . . . . 74.12 107.378 170.556 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.57 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 50.6 ttm -125.32 101.08 6.8 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 106.6 -1.63 . . . . 74.15 106.6 167.287 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.78 HG21 HG11 ' A' ' 115' ' ' VAL . 18.2 mm -81.01 107.44 13.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 107.921 -1.14 . . . . 65.52 107.921 -178.363 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.53 170.38 36.88 Favored Glycine 0 C--O 1.245 0.805 0 N-CA-C 109.689 -1.364 . . . . 61.42 109.689 171.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.544 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 6.9 p-10 -59.64 -51.41 69.94 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 123.854 0.384 . . . . 73.44 110.588 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -107.2 -30.46 8.74 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.01 0.524 . . . . 63.33 111.121 177.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -99.2 161.22 13.74 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.2 0.6 . . . . 75.12 111.876 -172.663 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.486 ' HB2' HD13 ' A' ' 40' ' ' LEU . 26.3 tp -134.24 112.04 10.74 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.747 0.819 . . . . 74.21 108.99 172.341 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.57 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 25.5 m -100.79 105.52 16.83 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.868 -0.79 . . . . 61.34 108.868 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 29' ' ' ALA . 33.4 mm -88.26 124.97 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 108.787 -0.819 . . . . 73.13 108.787 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -110.31 123.77 50.44 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.193 -1.04 . . . . 71.22 108.193 177.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.456 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -117.52 178.33 4.43 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.051 0.54 . . . . 75.45 110.67 -173.199 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.402 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 23.2 t70 -92.33 155.41 17.94 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.536 0.734 . . . . 72.3 110.432 173.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -58.26 -35.43 71.74 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.603 1.161 . . . . 71.22 113.635 -173.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 79.3 mtp -76.69 -21.38 55.45 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.847 0.459 . . . . 71.33 111.85 -175.641 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.506 HG11 ' HA3' ' A' ' 73' ' ' GLY . 10.9 t -103.21 121.08 54.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 108.824 -0.806 . . . . 74.44 108.824 -173.881 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -101.61 150.88 22.64 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.042 0.937 . . . . 75.15 109.271 -171.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.456 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 85.6 m95 -59.52 -15.71 19.77 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.893 1.071 . . . . 75.5 113.893 -172.386 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -58.61 -39.24 79.88 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.698 0.799 . . . . 72.33 111.692 176.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.3 t -91.29 -12.99 33.48 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.666 0.787 . . . . 74.42 111.32 -176.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.485 HG12 ' SG ' ' A' ' 71' ' ' CYS . 59.6 mt -103.27 -54.79 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 C-N-CA 123.769 0.828 . . . . 74.02 111.253 -168.501 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -54.34 -54.19 50.96 Favored Pre-proline 0 CA--C 1.566 1.596 0 C-N-CA 124.78 1.232 . . . . 63.33 113.494 -171.35 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.29 -36.12 80.98 Favored 'Trans proline' 0 C--N 1.401 3.318 0 C-N-CA 122.237 1.958 . . . . 74.15 112.237 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 15.6 mm-40 -62.65 -48.66 78.38 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.579 -0.737 . . . . 72.24 110.085 178.586 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.413 ' O ' HD13 ' A' ' 105' ' ' LEU . 50.9 mt -67.29 -41.79 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 123.395 0.678 . . . . 73.11 111.755 -177.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.521 HG23 ' HB ' ' A' ' 19' ' ' ILE . 57.9 mt -56.82 -41.25 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 123.112 0.565 . . . . 73.12 110.854 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -57.18 -52.13 66.54 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.46 0.704 . . . . 73.45 110.609 174.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.494 HD22 ' HB3' ' A' ' 66' ' ' GLN . 61.8 mt -64.04 -36.13 82.98 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.353 1.061 . . . . 54.21 112.316 -174.572 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.641 HD12 HD11 ' A' ' 63' ' ' LEU . 9.2 mp -69.88 -29.48 66.7 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.642 0.777 . . . . 53.54 111.028 177.814 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 50.3 m -78.14 -41.51 34.72 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.953 -0.758 . . . . 34.42 108.953 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -58.32 -56.86 16.57 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.337 1.055 . . . . 71.14 111.218 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.493 ' OE1' ' HB2' ' A' ' 63' ' ' LEU . 28.9 tt0 -58.04 -50.32 73.83 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.72 0.808 . . . . 71.03 111.585 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.403 ' HB2' HG13 ' A' ' 17' ' ' ILE . 82.4 mt -77.58 -18.07 57.23 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 115.049 -0.978 . . . . 64.12 111.639 -175.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.36 -42.57 71.64 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 122.746 0.419 . . . . 62.44 110.401 173.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -72.9 -19.33 61.29 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.858 -0.61 . . . . 74.32 110.361 172.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.81 59.58 2.77 Favored Glycine 0 C--N 1.344 1.022 0 CA-C-N 115.729 -0.669 . . . . 32.13 112.413 173.328 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -137.12 157.27 47.07 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 123.12 0.568 . . . . 73.2 110.119 177.704 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -80.68 160.46 24.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.803 1.241 . . . . 73.43 110.177 177.447 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.78 HG11 HG21 ' A' ' 79' ' ' ILE . 2.1 p -50.5 -50.31 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 124.521 1.129 . . . . 75.34 112.478 178.304 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.497 HD12 HG13 ' A' ' 115' ' ' VAL . 2.1 mp -74.94 -66.78 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 N-CA-C 108.625 -0.88 . . . . 61.24 108.625 175.448 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 53.2 m -148.31 -86.5 0.09 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.274 0.629 . . . . 64.24 110.25 -176.21 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -139.22 -50.05 0.51 Allowed 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 109.198 -0.667 . . . . 72.43 109.198 -178.082 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 . . . . . 0 C--O 1.251 1.132 0 N-CA-C 108.32 -0.992 . . . . 71.43 108.32 -176.026 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 mmt . . . . . 0 N--CA 1.477 0.88 0 N-CA-C 109.997 -0.371 . . . . 74.55 109.997 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -167.16 -144.17 4.03 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 111.183 -0.767 . . . . 53.24 111.183 177.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 57.81 27.89 15.16 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.187 0.995 . . . . 71.2 112.531 172.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.3 p80 -69.24 114.41 7.47 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 109.488 -0.56 . . . . 74.0 109.488 -178.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -94.52 138.27 32.63 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.607 0.763 . . . . 74.0 109.098 -178.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 -144.27 122.3 12.1 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 109.265 -0.643 . . . . 75.1 109.265 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -64.13 130.01 42.24 Favored 'General case' 0 C--O 1.24 0.557 0 O-C-N 123.871 0.732 . . . . 72.21 109.697 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.5 m80 -73.11 90.11 1.53 Allowed 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.567 -0.901 . . . . 65.31 108.567 178.164 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.4 t -58.92 98.52 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.288 1.035 . . . . 53.35 110.981 -176.764 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -99.29 156.39 17.01 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.661 0.784 . . . . 73.32 110.581 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 19.3 ptp -133.8 175.13 9.73 Favored 'General case' 0 C--O 1.243 0.747 0 CA-C-N 115.024 -0.989 . . . . 63.34 108.794 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -70.4 114.68 8.76 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.818 -0.628 . . . . 63.11 109.967 177.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.2 m -72.91 91.82 1.57 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.476 0.71 . . . . 62.43 109.509 176.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -91.41 151.55 20.77 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.512 0.725 . . . . 63.44 111.22 -173.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -89.75 96.97 10.93 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.804 -0.634 . . . . 73.34 109.988 -178.339 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -147.62 129.37 15.17 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.014 -1.476 . . . . 74.44 107.014 168.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.415 ' HB ' HG23 ' A' ' 106' ' ' THR . 72.9 mt -67.73 125.11 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 122.986 0.514 . . . . 71.41 110.816 -177.546 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.88 121.93 16.17 Favored 'General case' 0 C--O 1.242 0.666 0 O-C-N 123.902 0.751 . . . . 73.2 109.982 172.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 47.6 mm -127.16 116.59 44.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 105.915 -1.883 . . . . 73.42 105.915 172.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -101.69 151.75 21.66 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.83 -1.174 . . . . 71.04 107.83 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.8 m -122.7 112.61 18.15 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.202 -0.666 . . . . 74.13 109.202 175.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.7 mt -86.72 139.46 30.72 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.701 0.8 . . . . 42.54 110.086 176.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -78.77 144.7 34.91 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.525 0.73 . . . . 73.43 109.344 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.9 p -122.98 162.68 37.8 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 124.332 1.053 . . . . 74.23 109.667 -174.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -75.81 43.77 1.16 Allowed 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 123.008 2.472 . . . . 74.33 112.448 171.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -155.79 138.47 15.15 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.763 -0.829 . . . . 70.45 108.763 -176.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -81.39 -43.12 19.44 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.545 0.738 . . . . 63.14 110.876 178.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -67.53 -45.42 75.79 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.894 0.877 . . . . 71.11 110.31 -178.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.55 132.19 35.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.41 0.684 . . . . 54.21 110.907 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 tp -135.49 128.9 32.26 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 108.382 -0.97 . . . . 73.34 108.382 172.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -93.11 118.2 30.94 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.437 0.695 . . . . 63.44 111.5 -171.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -103.39 116.69 32.9 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.306 1.042 . . . . 61.31 108.25 172.487 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.7 tp -104.18 127.65 51.81 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.639 0.776 . . . . 71.13 110.088 -178.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.4 t -83.69 115.95 22.42 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.749 -0.834 . . . . 71.21 108.749 174.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 71.4 p -107.47 -43.46 4.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 122.825 0.45 . . . . 73.33 112.02 -171.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -102.1 -24.95 13.89 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 112.575 0.583 . . . . 75.33 112.575 -174.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLY . . . . . 0.403 ' HA3' HD13 ' A' ' 109' ' ' LEU . . . -81.75 -140.51 3.18 Favored Glycine 0 C--N 1.34 0.795 0 C-N-CA 121.603 -0.332 . . . . 74.12 112.504 -175.747 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.515 ' HB2' HD22 ' A' ' 109' ' ' LEU . 41.0 mt-10 -99.24 -171.67 2.12 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.398 0.679 . . . . 62.41 109.763 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 13.9 ttt -106.93 143.37 35.13 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.364 -0.976 . . . . 73.04 108.364 177.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -75.02 -56.61 4.56 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.561 0.744 . . . . 73.54 111.371 -174.683 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.472 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.7 tp-100 -129.94 171.38 12.82 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.378 1.071 . . . . 73.13 109.127 -173.603 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.0 m -58.12 134.1 56.17 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.518 1.127 . . . . 72.23 111.759 176.496 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -59.19 124.6 20.51 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.246 1.019 . . . . 70.42 112.67 -171.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 65.45 33.85 87.6 Favored Glycine 0 C--N 1.351 1.412 0 O-C-N 123.643 0.589 . . . . 72.23 113.923 175.501 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.7 t -89.34 -178.0 5.51 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.339 0.656 . . . . 75.54 109.329 174.595 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -77.02 127.87 33.47 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 109.585 -0.524 . . . . 74.34 109.585 174.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.0 p -65.25 119.59 11.18 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.042 0.937 . . . . 72.23 111.502 -179.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.0 mp -79.97 109.7 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.132 0.973 . . . . 70.43 109.028 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 96.4 t -91.94 114.81 29.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 108.664 -0.865 . . . . 53.44 108.664 178.403 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 70.4 mt -110.19 111.2 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 108.373 -0.973 . . . . 55.03 108.373 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -89.15 172.53 9.02 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 120.975 0.417 . . . . 74.15 110.25 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -65.24 -23.35 67.04 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.649 0.78 . . . . 73.32 110.935 170.582 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.2 p -79.45 -25.18 42.02 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.913 0.885 . . . . 60.22 111.145 175.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.409 ' O ' HG13 ' A' ' 58' ' ' ILE . 15.9 m-20 -83.86 55.91 3.46 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.643 0.777 . . . . 54.52 110.264 176.106 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -56.28 -35.79 67.88 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.81 0.844 . . . . 75.13 111.37 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.85 -42.67 84.92 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.123 0.969 . . . . 71.44 110.924 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.9 mt -79.13 -29.38 43.14 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.717 -0.674 . . . . 72.35 111.022 -178.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 54' ' ' ASP . 76.2 mt -63.36 -50.98 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 123.228 0.611 . . . . 62.51 109.557 175.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -59.9 -32.14 70.46 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.294 0.638 . . . . 52.13 110.572 176.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.403 ' HA ' ' HG3' ' A' ' 118' ' ' LYS . 24.4 t-80 -78.34 -15.45 58.7 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 122.725 0.41 . . . . 73.53 111.68 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 56.8 p -124.39 113.86 18.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.71 0.404 . . . . 74.15 110.881 -178.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -53.51 -47.43 69.9 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.138 1.375 . . . . 74.11 112.105 -176.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.46 ' HB2' ' OE1' ' A' ' 108' ' ' GLN . 24.9 tp -62.01 -39.99 94.15 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.143 -0.935 . . . . 73.12 111.97 -176.22 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.36 -45.58 93.0 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.245 0.618 . . . . 35.34 111.406 -177.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -54.69 -46.14 74.06 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.515 1.134 . . . . 72.04 110.863 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.418 ' HB3' HD22 ' A' ' 104' ' ' LEU . 18.3 mm100 -63.52 -45.54 90.15 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.108 0.963 . . . . 61.51 112.137 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.8 mt -65.11 -47.51 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.119 0.568 . . . . 75.41 111.171 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -65.65 -31.84 73.09 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.305 0.642 . . . . 64.41 111.501 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.34 -57.3 7.77 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.287 0.635 . . . . 55.41 111.063 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -72.2 -29.16 63.71 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.836 -0.62 . . . . 74.13 111.546 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.548 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 63.6 m -137.73 88.58 16.09 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 108.938 -0.764 . . . . 71.21 108.938 -179.161 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.79 -3.89 12.95 Favored 'Trans proline' 0 C--N 1.379 2.156 0 C-N-CA 123.052 2.501 . . . . 62.11 113.676 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.71 -15.72 80.96 Favored Glycine 0 C--N 1.352 1.418 0 O-C-N 123.196 0.31 . . . . 63.33 112.851 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.511 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 95.7 t -67.23 122.27 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 123.372 0.669 . . . . 52.22 109.649 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -83.31 -44.93 14.36 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.807 0.843 . . . . 74.11 110.739 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 61.5 p -155.01 170.92 20.65 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.511 0.672 . . . . 63.3 111.22 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 78.8 mt -129.97 156.72 43.98 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.93 1.292 . . . . 62.23 108.661 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.562 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 50.8 ttm -130.09 100.54 5.46 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.303 -1.369 . . . . 70.33 107.303 170.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.479 HD12 HG21 ' A' ' 115' ' ' VAL . 40.7 mm -74.67 107.73 5.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 107.547 -1.279 . . . . 73.45 107.547 176.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.66 -117.09 0.28 Allowed Glycine 0 C--N 1.34 0.777 0 N-CA-C 110.063 -1.215 . . . . 64.03 110.063 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.472 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 1.6 p-10 -149.32 -57.68 0.2 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.093 0.557 . . . . 75.04 109.657 171.174 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -83.69 -29.58 27.46 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.864 0.466 . . . . 65.43 109.791 170.89 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -116.47 170.3 8.67 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.982 0.913 . . . . 73.31 110.814 -174.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 46.0 tp -135.12 146.05 48.45 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.313 1.445 . . . . 72.23 107.471 171.456 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.562 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 35.5 m -127.71 130.18 48.4 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 109.132 -0.692 . . . . 73.34 109.132 175.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.1 mm -108.16 128.51 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 108.894 -0.78 . . . . 75.51 108.894 -178.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -109.11 107.2 17.42 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 108.882 -0.784 . . . . 73.12 108.882 178.324 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -106.6 163.59 12.76 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.216 0.606 . . . . 75.12 109.716 -178.821 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.65 145.23 38.95 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 122.635 0.374 . . . . 72.44 110.282 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -58.89 -34.94 72.22 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.181 0.992 . . . . 74.15 112.869 -173.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.8 mmm -70.85 -26.02 63.08 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.124 0.57 . . . . 73.23 110.559 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.5 t -91.77 142.3 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.044 -1.095 . . . . 65.52 108.044 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -109.03 146.2 34.32 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.944 0.498 . . . . 73.13 111.116 -174.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' TRP . . . . . 0.494 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 80.4 m95 -63.14 -13.54 38.0 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.054 0.941 . . . . 63.21 112.809 178.816 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -52.56 -39.71 61.78 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.173 0.989 . . . . 74.22 112.079 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 40.5 m -103.42 -0.53 29.88 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.366 0.667 . . . . 52.45 112.211 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.548 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 57.2 mt -109.49 -50.83 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 123.322 0.649 . . . . 61.15 111.275 -171.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.0 ttpm? -55.94 -51.74 78.08 Favored Pre-proline 0 CA--C 1.561 1.398 0 CA-C-O 117.778 -1.106 . . . . 74.51 113.28 -170.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.02 -33.65 91.74 Favored 'Trans proline' 0 C--N 1.4 3.266 0 C-N-CA 121.799 1.666 . . . . 34.43 112.157 -177.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 8.0 mm-40 -65.36 -47.51 76.17 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 115.513 -0.767 . . . . 75.41 110.24 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.1 mt -70.64 -37.97 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.042 0.537 . . . . 74.3 111.497 -177.835 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 97.9 mt -54.79 -44.37 71.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 N-CA-C 109.732 -0.47 . . . . 45.54 109.732 173.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 32.5 t70 -67.19 -40.74 86.55 Favored 'General case' 0 C--N 1.351 0.671 0 CA-C-N 115.039 -0.982 . . . . 72.42 111.181 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 95.9 mt -61.86 -39.96 93.68 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.803 0.841 . . . . 74.31 111.96 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.451 HD12 HD11 ' A' ' 63' ' ' LEU . 10.9 mp -71.06 -21.26 62.27 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.597 -0.729 . . . . 74.53 110.628 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.415 HG23 ' HB ' ' A' ' 17' ' ' ILE . 24.0 m -81.73 -37.88 26.6 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.985 -0.746 . . . . 74.11 108.985 174.742 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 103' ' ' ASP . 11.0 mmpt? -59.33 -62.57 1.78 Allowed 'General case' 0 C--N 1.368 1.388 0 C-N-CA 124.041 0.936 . . . . 73.4 110.924 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.46 ' OE1' ' HB2' ' A' ' 63' ' ' LEU . 25.9 tt0 -55.41 -47.13 76.39 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 124.658 1.224 . . . . 71.31 111.652 -171.72 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 38' ' ' GLU . 82.7 mt -70.83 -30.62 67.09 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 115.459 -0.791 . . . . 73.35 111.128 -178.149 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.39 -26.91 61.19 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.016 0.526 . . . . 73.05 111.348 176.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -72.77 -27.05 61.78 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.762 0.425 . . . . 71.33 110.148 170.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 91.59 36.02 6.67 Favored Glycine 0 C--N 1.346 1.117 0 N-CA-C 111.543 -0.623 . . . . 60.14 111.543 -177.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -120.54 159.57 24.94 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.155 0.982 . . . . 72.42 111.203 -173.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.9 174.02 6.06 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.338 1.055 . . . . 70.1 109.093 172.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.64 HG13 HD12 ' A' ' 116' ' ' ILE . 1.9 p -74.76 -55.81 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 N-CA-C 112.909 0.707 . . . . 72.22 112.909 -171.212 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.64 HD12 HG13 ' A' ' 115' ' ' VAL . 3.1 mp -71.54 98.59 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 CA-C-O 121.766 0.794 . . . . 74.45 108.88 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 51.4 p -99.29 -157.68 0.62 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.176 1.39 . . . . 73.54 110.335 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.403 ' HG3' ' HA ' ' A' ' 60' ' ' HIS . 75.1 mmtt 66.21 26.07 10.54 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 125.0 1.32 . . . . 74.13 112.258 178.53 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 CA--C 1.558 1.259 0 C-N-CA 123.942 0.897 . . . . 63.11 109.385 -179.987 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.488 1.431 0 N-CA-C 110.453 -0.202 . . . . 53.11 110.453 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.21 48.69 6.29 Favored Glycine 0 C--N 1.342 0.878 0 CA-C-N 116.16 -0.473 . . . . 44.25 113.307 176.256 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.7 m170 -75.48 99.75 4.3 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 109.481 -0.562 . . . . 74.55 109.481 173.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -111.09 159.97 17.32 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.245 1.018 . . . . 72.44 110.762 -175.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -140.12 137.96 34.88 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.595 0.758 . . . . 65.4 109.723 177.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -138.81 134.73 33.79 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.047 0.939 . . . . 61.1 109.179 177.223 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -68.94 99.49 1.07 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.748 0.819 . . . . 74.32 111.685 -174.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.2 m170 -89.65 131.95 35.38 Favored 'General case' 0 C--O 1.243 0.725 0 N-CA-C 108.109 -1.071 . . . . 61.24 108.109 172.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 64.0 p -79.61 127.36 32.07 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.996 0.518 . . . . 74.24 110.615 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -98.35 150.68 21.33 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.0 0.52 . . . . 61.33 109.601 175.59 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -88.08 112.15 22.34 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.562 0.745 . . . . 51.42 110.337 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -75.54 95.54 3.34 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 109.065 -0.717 . . . . 70.4 109.065 170.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.2 p -64.75 92.39 0.09 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.272 0.629 . . . . 41.33 110.229 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -73.16 -50.52 22.15 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.693 0.797 . . . . 61.12 110.007 -173.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -101.72 96.66 7.23 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.986 0.898 . . . . 62.24 109.575 169.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.519 ' H ' HD23 ' A' ' 16' ' ' LEU . 2.4 pt? -113.66 111.99 22.74 Favored 'General case' 0 C--O 1.242 0.7 0 N-CA-C 106.809 -1.552 . . . . 73.04 106.809 168.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.451 HG21 HD12 ' A' ' 109' ' ' LEU . 59.2 mt -90.08 138.39 19.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 115.35 -0.841 . . . . 74.43 110.313 -171.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -62.86 99.73 0.17 Allowed 'General case' 0 CA--C 1.548 0.884 0 O-C-N 124.032 0.833 . . . . 71.44 111.042 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.0 mm -119.66 107.0 20.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 106.044 -1.836 . . . . 70.34 106.044 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -99.36 127.57 45.4 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.392 -0.595 . . . . 71.21 109.392 -172.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.5 t -91.08 126.55 36.2 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-O 121.527 0.68 . . . . 63.23 109.635 -176.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.474 HD11 HD22 ' A' ' 33' ' ' LEU . 84.3 mt -123.58 138.08 54.62 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 124.566 1.146 . . . . 71.11 108.834 -176.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 62.3 p -74.73 147.95 40.9 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.539 -0.755 . . . . 74.14 110.621 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.7 p -117.31 162.97 25.49 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 123.977 0.911 . . . . 72.51 109.922 -176.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.83 -13.19 37.99 Favored 'Trans proline' 0 C--N 1.383 2.347 0 C-N-CA 122.6 2.2 . . . . 64.32 113.094 172.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -98.88 131.51 44.91 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.438 0.695 . . . . 74.43 109.208 175.393 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.8 -30.94 70.48 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.142 0.577 . . . . 65.32 111.164 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 26.8 p-10 -95.23 2.32 54.87 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.521 0.728 . . . . 74.14 112.401 -174.443 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -111.27 156.58 21.27 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.035 0.534 . . . . 60.02 110.188 174.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.7 tp -149.38 120.19 7.59 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 108.813 -0.81 . . . . 64.13 108.813 175.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -82.43 117.94 22.84 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.849 0.86 . . . . 71.12 110.194 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -100.26 119.34 38.24 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 107.73 -1.211 . . . . 74.01 107.73 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.474 HD22 HD11 ' A' ' 22' ' ' LEU . 27.3 tp -102.2 125.59 48.94 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.706 -0.85 . . . . 72.51 108.706 -172.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.5 m -85.61 105.87 16.5 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.206 -1.405 . . . . 61.25 107.206 175.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.9 p -94.05 101.11 13.13 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.533 0.733 . . . . 72.12 109.314 -178.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.4 t70 62.26 74.87 0.42 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.758 1.223 . . . . 72.31 111.033 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -151.85 -127.94 1.37 Allowed Glycine 0 C--N 1.342 0.865 0 CA-C-N 115.033 -0.985 . . . . 64.4 111.64 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.535 ' HB2' HD22 ' A' ' 109' ' ' LEU . 56.6 mm-40 -98.06 151.73 20.04 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 117.718 0.759 . . . . 73.14 111.269 178.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 12.0 tpt -88.04 99.75 12.41 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.146 -0.934 . . . . 75.51 108.902 177.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.04 -51.18 63.03 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.685 0.794 . . . . 44.14 111.986 -170.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.485 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.7 tp-100 -100.91 157.97 16.33 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.819 -0.808 . . . . 74.22 108.819 173.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 m -83.87 31.94 0.48 Allowed 'General case' 0 CA--C 1.567 1.631 0 C-N-CA 123.858 0.863 . . . . 72.45 112.033 -174.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.77 -78.19 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 125.608 1.563 . . . . 71.54 111.431 177.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -79.89 64.29 3.92 Favored Glycine 0 C--N 1.355 1.586 0 N-CA-C 111.832 -0.507 . . . . 71.21 111.832 177.107 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.6 t -160.59 141.63 11.93 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.664 1.186 . . . . 62.32 107.984 -171.537 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -61.2 146.22 48.46 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.398 0.679 . . . . 62.32 111.559 -178.087 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.5 p -69.68 97.74 1.1 Allowed 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 109.102 -0.703 . . . . 61.05 109.102 173.221 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 72.8 mt -72.44 109.49 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 115.709 -0.678 . . . . 61.42 110.366 -170.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.5 t -85.4 106.59 15.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 107.906 -1.146 . . . . 64.45 107.906 176.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.473 HG12 ' HB3' ' A' ' 57' ' ' LEU . 59.1 mt -96.33 109.65 23.24 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.349 0 N-CA-C 107.498 -1.297 . . . . 75.12 107.498 -177.054 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -92.4 160.18 15.22 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 117.737 0.244 . . . . 73.43 110.385 -178.311 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -66.76 -21.59 66.05 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.817 0.447 . . . . 64.31 111.382 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 10.0 t -93.06 -23.78 18.53 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.861 0.864 . . . . 51.12 110.536 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.14 69.82 10.52 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.235 -0.654 . . . . 63.14 109.235 174.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -64.2 -24.61 67.74 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.982 -1.008 . . . . 72.35 110.831 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -59.74 -36.83 77.4 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.95 0.9 . . . . 71.11 110.835 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.473 ' HB3' HG12 ' A' ' 50' ' ' ILE . 88.1 mt -82.9 -28.68 29.81 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.567 0.747 . . . . 62.13 111.517 176.026 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.472 HG22 ' HG2' ' A' ' 65' ' ' GLN . 61.7 mt -65.09 -40.14 87.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.45 0.7 . . . . 52.4 110.114 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -65.97 -17.11 64.46 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.113 0.565 . . . . 63.51 112.096 175.37 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -85.79 6.57 27.42 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.169 0.588 . . . . 61.43 112.31 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.49 ' HB2' HD13 ' A' ' 116' ' ' ILE . 38.2 t -159.74 114.83 2.38 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.247 0.619 . . . . 75.43 110.512 179.167 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 3.9 tppp? -63.16 -32.7 74.16 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.703 0.401 . . . . 72.45 110.844 173.641 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.451 HD11 ' HB3' ' A' ' 104' ' ' LEU . 44.8 tp -63.73 -41.18 98.09 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 122.783 0.433 . . . . 71.43 110.367 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.61 -44.57 96.16 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 123.16 0.584 . . . . 73.21 110.324 177.604 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.472 ' HG2' HG22 ' A' ' 58' ' ' ILE . 76.2 mt-30 -55.5 -42.93 75.12 Favored 'General case' 0 C--N 1.351 0.66 0 O-C-N 124.497 1.123 . . . . 72.44 110.973 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 14.6 mm100 -69.73 -38.29 76.81 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.124 0.569 . . . . 73.25 112.427 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ILE . . . . . 0.453 HG22 HG21 ' A' ' 74' ' ' VAL . 81.8 mt -68.32 -48.16 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 122.716 0.406 . . . . 61.41 110.473 -178.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -65.19 -32.3 73.91 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.754 -0.657 . . . . 70.25 111.391 177.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.5 tp -67.66 -56.38 9.58 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.236 0.614 . . . . 71.51 110.692 177.662 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -59.41 -34.04 71.96 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.738 0.815 . . . . 43.42 112.015 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.528 ' SG ' HG23 ' A' ' 97' ' ' ILE . 63.8 m -137.05 114.89 10.02 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 110.183 -0.303 . . . . 52.44 110.183 -176.189 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -71.72 -11.04 27.45 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.327 2.018 . . . . 70.43 111.849 171.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -88.04 18.65 39.01 Favored Glycine 0 C--N 1.355 1.601 0 CA-C-O 119.79 -0.45 . . . . 74.32 113.277 -177.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.631 HG22 ' NZ ' ' A' ' 88' ' ' LYS . 15.1 t -97.54 124.79 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 108.794 -0.817 . . . . 75.43 108.794 172.26 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -84.2 -52.21 6.43 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.656 0.382 . . . . 61.41 110.297 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 97.1 p -156.18 172.31 18.67 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 112.057 0.391 . . . . 62.41 112.057 -177.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 34.5 mt -131.47 126.03 33.98 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 108.226 -1.027 . . . . 74.3 108.226 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.486 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.3 ttm -100.92 111.56 23.8 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.775 -0.824 . . . . 73.43 108.775 178.716 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.616 HD13 HD13 ' A' ' 84' ' ' LEU . 20.9 mm -86.16 98.05 6.48 Favored 'Isoleucine or valine' 0 C--N 1.349 0.564 0 N-CA-C 108.82 -0.807 . . . . 71.34 108.82 -177.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.06 176.27 42.15 Favored Glycine 0 C--O 1.243 0.715 0 N-CA-C 111.174 -0.77 . . . . 50.4 111.174 176.019 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.485 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 31.1 m-20 -51.48 -59.74 3.92 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.265 1.026 . . . . 74.1 111.611 -176.216 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -128.5 22.46 5.97 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.153 -1.385 . . . . 74.44 110.016 -174.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PHE . . . . . 0.441 ' HB3' HD12 ' A' ' 33' ' ' LEU . 37.0 p90 -149.12 154.94 39.95 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 122.895 0.478 . . . . 74.54 110.789 -175.162 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.616 HD13 HD13 ' A' ' 79' ' ' ILE . 27.5 tp -131.34 110.95 11.44 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 108.082 -1.081 . . . . 70.13 108.082 176.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 41.7 m -100.01 109.73 22.05 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 108.48 -0.934 . . . . 51.42 108.48 -176.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.547 HG13 HD13 ' A' ' 101' ' ' ILE . 20.9 mm -86.38 131.71 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 N-CA-C 108.012 -1.107 . . . . 72.02 108.012 -175.362 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -112.0 124.44 52.4 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.017 -1.105 . . . . 71.22 108.017 178.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.631 ' NZ ' HG22 ' A' ' 74' ' ' VAL . 69.1 mttm -129.12 177.39 7.18 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.318 1.047 . . . . 73.55 109.475 -178.307 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.11 139.37 58.76 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.49 0.494 . . . . 72.3 109.956 168.597 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -62.1 -27.52 68.98 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.661 0.784 . . . . 61.42 112.571 -174.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 26.4 mmt -87.38 -16.72 34.14 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.584 0.354 . . . . 74.01 111.659 -178.111 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 72.6 t -75.57 133.76 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.395 -0.965 . . . . 63.05 108.395 173.049 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 65.5 m170 -104.53 148.88 25.99 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.25 0.548 . . . . 72.14 110.33 -176.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -76.94 -19.13 57.74 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.134 0.974 . . . . 75.24 112.262 -173.278 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -57.7 -26.95 62.45 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.901 0.48 . . . . 74.55 111.667 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -82.81 -52.49 6.69 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 122.961 0.505 . . . . 75.44 111.989 177.215 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.528 HG23 ' SG ' ' A' ' 71' ' ' CYS . 26.8 mt -93.94 -33.46 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 113.133 0.79 . . . . 55.41 113.133 -164.386 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -49.43 -46.74 78.16 Favored Pre-proline 0 CA--C 1.568 1.667 0 CA-C-O 117.564 -1.207 . . . . 70.02 113.784 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -56.0 -35.59 94.76 Favored 'Trans proline' 0 C--N 1.396 3.029 0 CA-C-N 121.626 1.616 . . . . 60.42 112.844 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -73.16 -34.83 66.27 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.207 0.603 . . . . 51.51 110.595 -179.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.547 HD13 HG13 ' A' ' 86' ' ' ILE . 84.0 mt -68.5 -49.06 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.481 0.712 . . . . 75.32 109.921 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 87.1 mt -58.23 -38.07 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.594 0.758 . . . . 74.2 110.301 177.306 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ASP . . . . . 0.401 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 13.6 t70 -61.98 -51.53 67.69 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.829 0.852 . . . . 73.42 110.923 176.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.451 ' HB3' HD11 ' A' ' 63' ' ' LEU . 69.7 mt -62.9 -39.38 94.33 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.09 0.956 . . . . 55.23 111.92 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.491 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 8.5 mp -70.42 -28.55 65.14 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.398 0.679 . . . . 62.43 110.5 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 94.8 m -69.58 -37.06 76.82 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 109.111 -0.699 . . . . 74.11 109.111 174.743 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' A' ' 103' ' ' ASP . 45.3 mmtm -67.9 -44.95 75.76 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.053 0.541 . . . . 72.13 110.328 178.61 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -58.23 -47.23 84.18 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.447 1.099 . . . . 75.55 111.017 -178.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 38' ' ' GLU . 18.0 mt -76.4 -26.55 55.7 Favored 'General case' 0 CA--C 1.553 1.08 0 CA-C-N 115.821 -0.627 . . . . 73.3 110.708 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.26 -21.88 60.52 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.042 0.537 . . . . 74.11 111.69 178.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -69.4 -24.81 63.9 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 110.133 -0.321 . . . . 44.33 110.133 170.357 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 71.76 38.52 60.82 Favored Glycine 0 C--N 1.347 1.161 0 N-CA-C 111.079 -0.808 . . . . 63.12 111.079 -174.395 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -135.59 160.4 38.62 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 124.11 0.964 . . . . 71.31 111.643 -173.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -78.93 152.59 31.01 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 114.404 -1.271 . . . . 63.24 109.293 177.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.599 HG13 HG12 ' A' ' 116' ' ' ILE . 7.8 p -76.44 -36.91 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 122.839 0.456 . . . . 73.54 110.535 178.489 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.599 HG12 HG13 ' A' ' 115' ' ' VAL . 43.7 mm -114.83 151.12 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.356 1.062 . . . . 74.32 108.937 178.007 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 37.5 t -88.99 172.99 8.72 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.029 0.532 . . . . 72.32 110.092 175.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -16.81 60.78 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.269 0.628 . . . . 74.14 110.696 173.691 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 . . . . . 0 C--O 1.253 1.275 0 C-N-CA 124.45 1.1 . . . . 72.11 110.535 -178.485 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.484 1.239 0 N-CA-C 109.707 -0.479 . . . . 55.04 109.707 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.95 45.96 1.06 Allowed Glycine 0 C--N 1.348 1.212 0 O-C-N 123.344 0.402 . . . . 71.14 112.151 -177.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -156.38 154.68 30.9 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.29 1.036 . . . . 75.12 108.238 178.472 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 26.8 p80 -149.73 169.21 21.58 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.329 0.651 . . . . 74.22 109.629 179.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.4 p-80 -150.95 136.51 17.9 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.659 0.384 . . . . 74.04 110.53 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -116.29 169.98 8.88 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.167 0.987 . . . . 53.51 109.329 173.076 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -135.97 103.22 5.29 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.831 0.852 . . . . 71.4 110.081 -175.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 38.1 m-70 -103.65 104.05 14.04 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.627 0.771 . . . . 70.33 109.439 177.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -90.23 61.99 5.29 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 108.548 -0.908 . . . . 64.53 108.548 173.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -76.98 94.65 4.0 Favored 'General case' 0 C--N 1.351 0.646 0 CA-C-N 115.302 -0.863 . . . . 62.45 109.814 -176.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ttt -72.39 91.84 1.39 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 115.573 -0.74 . . . . 71.34 110.212 177.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.3 p-10 -93.79 148.91 21.69 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 108.808 -0.812 . . . . 51.12 108.808 171.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.4 t -143.36 109.85 5.44 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.483 -0.562 . . . . 73.4 109.483 -177.529 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -145.37 150.13 36.02 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 124.356 1.063 . . . . 72.42 108.218 175.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -85.67 106.18 16.76 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 109.769 -0.456 . . . . 75.13 109.769 -175.765 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.6 mp -76.38 91.24 3.26 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.195 -0.669 . . . . 74.24 109.195 174.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.572 ' H ' HG23 ' A' ' 106' ' ' THR . 64.5 mt -59.51 110.44 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 114.58 -1.191 . . . . 71.23 109.304 174.583 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -71.89 136.18 46.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.521 -0.763 . . . . 74.51 109.229 -176.747 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 48.9 mm -118.55 143.32 29.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 N-CA-C 107.9 -1.148 . . . . 64.33 107.9 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HD2' HD23 ' A' ' 33' ' ' LEU . 40.4 ttmt -91.49 114.97 27.64 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.421 -0.585 . . . . 64.22 109.421 -177.516 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 97.6 m -95.05 120.88 36.01 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 108.93 -0.767 . . . . 74.54 108.93 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.6 mt -125.23 141.91 51.81 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.333 1.053 . . . . 72.43 109.536 -174.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.6 p -73.97 143.37 45.67 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.143 0.577 . . . . 72.24 110.44 174.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.3 p -111.95 160.89 28.19 Favored Pre-proline 0 N--CA 1.478 0.947 0 C-N-CA 124.245 1.018 . . . . 72.21 109.401 -178.697 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -79.29 30.85 0.47 Allowed 'Trans proline' 0 C--N 1.375 1.95 0 C-N-CA 123.192 2.595 . . . . 71.14 112.855 172.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -142.28 127.43 18.57 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.398 -0.964 . . . . 64.44 108.398 -177.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -73.2 158.22 35.66 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.382 -0.599 . . . . 63.12 109.382 173.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 70.49 -6.46 1.19 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.113 1.365 . . . . 72.32 111.68 -173.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.42 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -117.57 145.51 44.23 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 124.101 0.961 . . . . 63.5 109.758 -172.598 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.6 tp -153.2 129.69 10.67 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 108.864 -0.791 . . . . 75.54 108.864 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -82.82 131.53 35.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.754 0.821 . . . . 63.5 111.127 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -122.19 114.37 20.76 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.977 -1.49 . . . . 73.21 106.977 172.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.46 HD23 ' HD2' ' A' ' 20' ' ' LYS . 52.7 tp -113.86 127.92 56.19 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 123.983 0.913 . . . . 61.22 110.269 -165.782 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 m -90.29 103.73 16.38 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.156 -1.053 . . . . 63.32 108.156 177.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 73.5 p -102.34 -11.45 18.66 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.966 0.907 . . . . 64.12 111.578 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -62.88 -44.93 94.79 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.943 0.897 . . . . 73.43 111.875 -177.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 150.83 -32.4 0.98 Allowed Glycine 0 C--N 1.346 1.108 0 CA-C-N 116.277 -0.42 . . . . 53.32 113.184 178.852 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -69.98 106.66 3.28 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.036 0.446 . . . . 51.03 109.829 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.5 tpt -85.2 133.97 34.17 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.319 1.048 . . . . 62.42 109.865 -171.606 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.415 ' O ' HG12 ' A' ' 115' ' ' VAL . 73.5 mt -70.46 -35.59 73.41 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.473 0.709 . . . . 73.41 112.756 -172.402 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 53.5 mt-30 -141.53 165.6 27.05 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 107.874 -1.158 . . . . 72.2 107.874 172.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 29.9 m -60.57 121.63 12.66 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 123.355 0.409 . . . . 61.12 110.063 178.289 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -54.92 118.07 3.97 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.259 1.024 . . . . 72.14 111.674 -168.144 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.57 11.45 14.9 Favored Glycine 0 C--N 1.34 0.772 0 CA-C-N 115.342 -0.845 . . . . 75.13 111.962 -170.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.57 ' HB3' ' HB3' ' A' ' 81' ' ' ASP . 35.1 t -84.8 156.75 21.22 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.647 0.779 . . . . 73.11 110.908 179.629 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -81.22 154.28 26.73 Favored 'General case' 0 C--O 1.246 0.892 0 C-N-CA 123.932 0.893 . . . . 72.44 110.116 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.0 p -79.39 91.47 5.09 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.902 0.481 . . . . 72.23 109.825 176.345 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.3 mt -75.77 116.69 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.018 0.927 . . . . 75.31 109.866 -176.904 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.5 t -90.88 119.28 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 108.579 -0.897 . . . . 72.34 108.579 178.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.411 HG23 ' HB2' ' A' ' 57' ' ' LEU . 61.3 mt -117.11 110.65 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 107.775 -1.194 . . . . 70.15 107.775 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.402 ' HG2' ' HB2' ' A' ' 76' ' ' SER . 10.2 mtmp? -93.29 172.58 8.2 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 109.595 -0.52 . . . . 74.15 109.595 177.643 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.9 p30 -64.7 -21.15 66.68 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.212 0.605 . . . . 70.15 112.345 -177.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.5 t -83.92 -21.18 31.95 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 122.507 0.323 . . . . 74.23 110.717 176.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -83.23 56.33 3.49 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.999 0.92 . . . . 73.42 110.296 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.425 ' HA ' HD12 ' A' ' 58' ' ' ILE . 34.5 tt0 -63.73 -25.72 68.32 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.457 0.703 . . . . 63.22 111.667 -175.096 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.18 -45.51 93.08 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.79 0.836 . . . . 72.32 110.281 173.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.411 ' HB2' HG23 ' A' ' 50' ' ' ILE . 87.0 mt -73.29 -30.03 63.13 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 115.703 -0.681 . . . . 71.22 111.106 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 55' ' ' GLU . 75.5 mt -65.28 -39.06 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.203 0.601 . . . . 73.03 109.427 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -70.68 -10.85 60.34 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 112.965 0.728 . . . . 73.04 112.965 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 46.3 m80 -80.79 -34.3 34.19 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.701 0.4 . . . . 54.0 110.619 170.561 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.487 ' HB2' HD13 ' A' ' 116' ' ' ILE . 39.3 t -108.65 106.78 16.98 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.326 0.65 . . . . 61.43 110.611 -177.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -54.77 -37.51 66.09 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.392 0.677 . . . . 72.15 110.809 173.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.13 -42.55 99.52 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.537 0.735 . . . . 73.55 111.033 178.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.79 -45.08 93.41 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 122.819 0.448 . . . . 72.41 109.833 178.638 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -55.95 -44.38 78.37 Favored 'General case' 0 C--N 1.353 0.734 0 O-C-N 124.065 0.853 . . . . 74.13 110.812 177.382 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -62.36 -46.56 88.09 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.69 0.796 . . . . 73.3 112.069 178.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.9 mt -64.71 -49.83 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 C-N-CA 123.641 0.776 . . . . 61.44 111.065 -175.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -66.76 -36.19 81.85 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.417 0.687 . . . . 64.43 111.502 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.9 tp -64.99 -46.6 80.76 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.444 0.698 . . . . 73.33 110.835 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.493 ' NE2' HD21 ' A' ' 104' ' ' LEU . 75.3 mt-30 -73.21 -28.92 62.45 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.123 -0.944 . . . . 63.3 111.642 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.439 ' SG ' HD13 ' A' ' 97' ' ' ILE . 42.9 t -149.08 104.16 3.36 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 122.47 0.308 . . . . 64.12 110.783 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -78.08 14.55 1.51 Allowed 'Trans proline' 0 C--N 1.373 1.816 0 C-N-CA 122.738 2.292 . . . . 43.45 112.745 171.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -85.77 -18.42 59.9 Favored Glycine 0 C--N 1.35 1.322 0 N-CA-C 111.764 -0.535 . . . . 75.03 111.764 170.184 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.424 ' HA ' ' HB3' ' A' ' 88' ' ' LYS . 87.7 t -70.74 114.59 8.89 Favored 'Isoleucine or valine' 0 C--N 1.351 0.669 0 N-CA-C 109.228 -0.656 . . . . 70.24 109.228 175.402 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -86.02 -32.95 21.19 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.264 0.626 . . . . 72.51 110.678 -174.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' SER . . . . . 0.402 ' HB2' ' HG2' ' A' ' 51' ' ' LYS . 33.4 t -161.45 167.14 26.13 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 121.345 0.593 . . . . 54.0 111.319 -175.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 76.7 mt -134.4 128.61 33.92 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.721 1.208 . . . . 71.0 107.928 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.48 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 54.1 ttm -96.21 108.18 20.61 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 107.371 -1.344 . . . . 71.12 107.371 168.088 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 20.1 mm -91.33 105.38 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.437 0.695 . . . . 71.4 109.146 -174.562 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.87 163.29 24.5 Favored Glycine 0 C--O 1.242 0.636 0 N-CA-C 109.657 -1.377 . . . . 61.52 109.657 173.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ASP . . . . . 0.57 ' HB3' ' HB3' ' A' ' 45' ' ' SER . 19.3 p-10 -74.08 -34.92 64.18 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 122.885 0.474 . . . . 71.32 110.595 175.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -99.55 -32.86 10.89 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.933 0.893 . . . . 73.04 111.259 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -131.28 169.28 16.19 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.276 0.63 . . . . 73.55 111.739 -170.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 54.2 tp -141.12 109.94 6.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.625 0.77 . . . . 63.35 109.619 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.48 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 59.8 m -100.79 111.57 23.82 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.713 -0.847 . . . . 41.04 108.713 -178.403 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.532 HG13 HD13 ' A' ' 101' ' ' ILE . 27.2 mm -86.99 126.22 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.487 -0.931 . . . . 55.45 108.487 -176.753 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.52 124.63 50.75 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.355 -0.98 . . . . 55.22 108.355 176.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 74' ' ' VAL . 0.6 OUTLIER -150.2 152.96 35.45 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.228 1.011 . . . . 71.44 109.154 -177.042 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -60.57 132.32 53.54 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.203 0.601 . . . . 65.22 110.427 -172.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -62.39 -23.4 66.81 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.633 1.173 . . . . 74.12 112.493 -175.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.2 mmt -66.21 -30.86 71.39 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.865 0.466 . . . . 75.45 110.679 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.6 t -92.98 142.83 12.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 N-CA-C 107.151 -1.426 . . . . 64.13 107.151 172.433 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -102.72 156.82 17.38 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.34 0.59 . . . . 64.31 111.579 -176.204 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -69.02 -17.84 63.96 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 114.629 -1.169 . . . . 54.14 111.795 179.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -56.01 -31.08 62.75 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.756 0.822 . . . . 74.43 111.806 -177.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.9 m -92.08 -36.17 13.5 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.382 0.673 . . . . 64.11 112.034 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.439 HD13 ' SG ' ' A' ' 71' ' ' CYS . 30.4 mt -97.74 -43.15 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 N-CA-C 112.305 0.483 . . . . 71.3 112.305 -164.796 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -51.78 -46.15 91.86 Favored Pre-proline 0 N--CA 1.492 1.634 0 CA-C-O 117.76 -1.114 . . . . 73.4 113.68 -177.022 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -53.83 -41.88 70.98 Favored 'Trans proline' 0 C--N 1.402 3.361 0 C-N-CA 121.839 1.693 . . . . 73.14 112.337 173.02 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -67.66 -39.48 84.56 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.345 -0.843 . . . . 70.35 110.486 -178.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.532 HD13 HG13 ' A' ' 86' ' ' ILE . 93.7 mt -62.89 -51.54 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.572 0.749 . . . . 72.45 110.395 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 83.7 mt -59.8 -38.28 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 O-C-N 123.748 0.655 . . . . 65.01 110.682 -178.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -67.94 -39.31 83.46 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.018 0.927 . . . . 61.03 111.278 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.493 HD21 ' NE2' ' A' ' 70' ' ' GLN . 77.7 mt -65.72 -39.99 91.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.565 0.746 . . . . 73.11 111.799 174.058 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 10.8 mp -68.99 -25.0 64.3 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.032 0.533 . . . . 75.02 110.36 176.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.572 HG23 ' H ' ' A' ' 17' ' ' ILE . 88.6 m -71.61 -50.91 26.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 122.984 0.514 . . . . 73.31 110.038 176.748 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -65.67 -36.47 83.75 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 123.386 0.429 . . . . 73.52 110.879 -176.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -59.41 -56.33 23.37 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 122.72 0.408 . . . . 55.33 110.62 177.613 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 105' ' ' LEU . 50.2 mt -69.65 -22.47 63.45 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 123.792 0.683 . . . . 74.42 111.333 -176.653 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.67 -35.84 70.43 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.567 0.747 . . . . 72.23 111.888 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -108.26 -13.47 14.89 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 122.952 0.501 . . . . 74.11 111.474 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -148.7 -159.12 8.35 Favored Glycine 0 C--N 1.345 1.063 0 N-CA-C 112.082 -0.407 . . . . 62.22 112.082 -175.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -131.85 -60.17 0.93 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.754 0.822 . . . . 72.11 109.106 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -79.87 171.38 15.19 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.31 -1.314 . . . . 51.2 111.98 -174.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.476 HG13 HG12 ' A' ' 116' ' ' ILE . 5.4 p -110.95 -37.75 3.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-N 114.085 -1.416 . . . . 74.31 109.874 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.487 HD13 ' HB2' ' A' ' 61' ' ' SER . 41.9 mm -92.06 -80.51 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 122.743 0.417 . . . . 75.42 109.882 -178.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.7 m -152.3 156.36 39.48 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.871 0.469 . . . . 70.12 111.153 -171.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' LYS . . . . . 0.412 ' HD3' ' H ' ' A' ' 118' ' ' LYS . 0.4 OUTLIER -125.32 31.16 5.63 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.379 1.072 . . . . 75.23 108.86 173.263 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 . . . . . 0 C--O 1.251 1.137 0 C-N-CA 124.105 0.962 . . . . 61.4 109.04 179.693 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mpp? . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 109.314 -0.625 . . . . 70.34 109.314 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 130.29 122.17 2.39 Favored Glycine 0 C--N 1.34 0.79 0 N-CA-C 110.747 -0.941 . . . . 62.54 110.747 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 39.4 p-80 -149.91 112.14 4.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.341 0.656 . . . . 73.13 109.509 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -162.27 108.65 1.27 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.746 0.818 . . . . 72.43 109.406 178.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -156.36 41.02 0.36 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.201 1.001 . . . . 70.34 109.473 -177.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -66.57 147.72 52.89 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.81 0.844 . . . . 75.3 111.478 -177.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 -111.35 143.07 42.75 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.901 0.88 . . . . 53.04 110.259 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -175.01 121.53 0.22 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.125 0.97 . . . . 64.33 108.998 168.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.1 m -141.99 114.94 8.68 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.272 0.629 . . . . 72.2 110.833 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -90.14 139.55 30.52 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.587 0.755 . . . . 75.14 109.504 174.512 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.1 ptp -149.8 104.78 3.35 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.209 0.528 . . . . 64.41 110.366 -176.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -159.24 111.0 2.11 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 108.939 -0.763 . . . . 72.53 108.939 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 t -92.08 7.46 42.28 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.701 0.8 . . . . 62.55 111.156 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -89.69 157.69 17.88 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.775 0.83 . . . . 63.23 110.001 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.51 134.76 19.39 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 108.553 -0.906 . . . . 74.12 108.553 170.531 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -116.68 162.79 17.11 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.007 0.523 . . . . 63.35 110.296 -178.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.458 ' HB ' ' HA ' ' A' ' 106' ' ' THR . 69.0 mt -79.26 117.86 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 123.608 0.763 . . . . 71.24 110.78 -177.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -83.1 131.13 35.16 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 124.568 1.147 . . . . 75.5 110.47 -175.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ILE . . . . . 0.403 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.9 mm -130.17 121.32 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 N-CA-C 108.059 -1.089 . . . . 74.22 108.059 -175.313 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -90.77 143.34 26.83 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.732 1.213 . . . . 75.23 110.021 -179.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 47.1 m -101.83 120.28 40.12 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 123.43 0.692 . . . . 73.11 109.727 175.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.8 mt -125.16 138.17 54.15 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.133 0.973 . . . . 72.33 109.633 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.5 p -86.66 144.46 27.13 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.06 0.544 . . . . 74.21 110.615 178.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.4 p -108.34 172.78 3.44 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 124.875 1.27 . . . . 75.24 108.469 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -75.57 50.56 2.72 Favored 'Trans proline' 0 C--N 1.376 2.001 0 C-N-CA 122.13 1.887 . . . . 74.22 112.372 168.688 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -162.27 141.14 9.21 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.344 1.058 . . . . 73.54 108.504 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.29 -31.94 13.86 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.137 0.575 . . . . 62.44 110.593 -177.899 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -89.78 7.49 36.65 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.916 0.886 . . . . 74.15 111.798 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.466 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -136.53 126.17 25.4 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.796 0.838 . . . . 63.22 109.052 174.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.1 tp -128.42 134.24 48.74 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.461 0.704 . . . . 63.51 109.177 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -90.87 129.74 36.89 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.479 1.111 . . . . 54.33 110.538 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -114.7 116.41 28.65 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.717 -1.216 . . . . 75.34 107.717 171.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.4 tp -100.06 127.32 46.31 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.451 -1.314 . . . . 75.02 107.451 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.2 t -72.39 107.33 4.91 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 107.254 -1.388 . . . . 73.25 107.254 171.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t -105.64 18.97 21.33 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.474 0.654 . . . . 75.02 109.73 -179.26 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -91.32 -55.5 3.49 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.368 0.667 . . . . 64.34 109.888 177.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 156.65 -17.13 0.41 Allowed Glycine 0 C--N 1.344 1.024 0 CA-C-N 115.908 -0.587 . . . . 31.53 113.171 -175.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -84.92 105.76 15.93 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.24 0.616 . . . . 62.11 111.229 -176.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 40.2 ttm -74.97 132.91 41.73 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.502 -0.555 . . . . 75.11 109.502 175.212 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.3 mt -62.64 -48.72 78.12 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.826 0.704 . . . . 73.05 111.342 -177.239 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -132.5 -84.77 0.48 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.182 -0.463 . . . . 73.44 109.843 -179.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 94.9 m -162.33 146.2 11.91 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.958 0.903 . . . . 71.32 108.578 -174.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.0 ppt_? -72.6 144.05 48.0 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.622 0.369 . . . . 73.22 111.447 173.415 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 80.49 21.8 63.64 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.754 -0.657 . . . . 71.41 113.13 -178.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m -91.97 159.79 15.57 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.191 0.597 . . . . 71.05 110.79 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -97.3 126.6 42.63 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.755 -1.202 . . . . 73.02 107.755 170.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.8 m -59.56 121.53 11.8 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.853 0.861 . . . . 75.51 112.995 -169.489 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 61.4 mt -87.34 130.89 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.011 0.925 . . . . 72.51 110.085 -178.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.5 t -97.46 108.64 21.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 N-CA-C 109.263 -0.643 . . . . 75.35 109.263 178.646 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 72.1 mt -90.38 110.04 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.549 1.14 . . . . 75.33 107.961 175.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -84.24 144.36 28.98 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.544 0.738 . . . . 72.43 110.205 -174.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.4 ' HA ' HD11 ' A' ' 58' ' ' ILE . 31.8 p-10 -65.79 -29.27 69.73 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.086 0.554 . . . . 72.15 111.321 175.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 t -82.15 -14.38 55.76 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.818 0.847 . . . . 64.14 111.208 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -102.61 82.46 2.15 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.232 -1.025 . . . . 74.14 108.232 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.415 ' HA ' HD12 ' A' ' 58' ' ' ILE . 0.1 OUTLIER -57.5 -25.05 59.21 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.117 0.967 . . . . 75.04 112.519 -178.298 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -65.39 -52.68 51.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.201 0.601 . . . . 74.34 110.992 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.45 -36.18 77.61 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.951 0.5 . . . . 73.03 110.39 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.415 HD12 ' HA ' ' A' ' 55' ' ' GLU . 68.8 mt -64.46 -47.12 90.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 115.023 -0.99 . . . . 72.22 110.522 177.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 91.2 m-20 -62.12 -32.19 72.73 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.334 0.654 . . . . 75.34 112.42 -178.974 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -80.08 -6.47 57.73 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.018 0.527 . . . . 75.31 112.047 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.419 ' HB3' HG12 ' A' ' 116' ' ' ILE . 23.4 p -131.65 104.46 6.94 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.426 0.691 . . . . 52.32 109.558 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -52.21 -38.28 57.47 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.146 0.978 . . . . 72.34 112.285 -178.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.5 HD11 HD12 ' A' ' 105' ' ' LEU . 22.7 tp -61.89 -42.29 98.9 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 123.975 0.797 . . . . 73.2 111.769 179.098 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.47 -44.12 95.37 Favored 'General case' 0 C--N 1.351 0.669 0 O-C-N 123.66 0.6 . . . . 74.32 110.804 -177.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 26.3 mt-30 -54.86 -48.04 73.43 Favored 'General case' 0 C--N 1.348 0.525 0 O-C-N 124.122 0.889 . . . . 74.54 110.643 176.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -63.48 -44.62 93.87 Favored 'General case' 0 CA--C 1.552 1.028 0 O-C-N 123.87 0.731 . . . . 71.32 112.84 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -65.77 -49.68 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 123.328 0.651 . . . . 53.53 110.868 -176.625 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -69.93 -30.0 67.29 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.656 0.382 . . . . 74.44 111.809 -178.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 67.1 tp -64.11 -48.72 75.01 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.59 0.756 . . . . 72.41 110.693 175.771 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -86.78 -16.88 34.93 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.068 -0.969 . . . . 71.22 111.943 -173.512 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 54.0 t -149.44 104.62 3.29 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 122.928 0.491 . . . . 73.12 110.383 177.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -78.94 5.72 5.49 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.671 2.247 . . . . 63.41 112.765 172.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.23 -26.68 67.76 Favored Glycine 0 C--N 1.354 1.539 0 N-CA-C 112.262 -0.335 . . . . 44.21 112.262 176.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 40.7 t -75.36 127.73 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.056 0.542 . . . . 60.33 110.368 -176.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -89.06 -36.43 15.78 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.282 1.033 . . . . 53.2 111.026 -177.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.1 p -164.63 162.02 21.24 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 121.339 0.59 . . . . 62.51 111.633 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.9 mt -118.72 131.14 56.13 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.609 1.163 . . . . 62.54 108.168 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.514 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 43.0 ttm -105.21 103.85 13.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.407 -0.96 . . . . 54.33 108.407 175.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.478 HD13 HD13 ' A' ' 84' ' ' LEU . 49.3 mm -82.38 106.92 13.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 124.447 1.099 . . . . 75.13 108.773 -177.024 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.54 -163.9 39.55 Favored Glycine 0 C--O 1.246 0.863 0 O-C-N 123.688 0.617 . . . . 74.24 111.876 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -64.24 -66.16 0.58 Allowed 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.61 0.719 . . . . 65.34 110.036 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -127.89 10.57 6.51 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 114.055 -1.43 . . . . 71.23 109.603 -175.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -132.52 153.59 50.79 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.987 0.915 . . . . 73.55 110.344 -174.88 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.478 HD13 HD13 ' A' ' 79' ' ' ILE . 46.0 tp -131.64 117.96 19.39 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.221 1.008 . . . . 63.03 109.524 -175.855 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.514 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 28.9 m -105.16 111.43 24.19 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.288 -0.634 . . . . 75.0 109.288 -178.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.511 HG13 HD13 ' A' ' 101' ' ' ILE . 22.4 mm -88.01 126.99 41.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 123.31 0.644 . . . . 73.54 109.335 -175.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -104.2 109.61 21.5 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.227 -1.027 . . . . 62.41 108.227 174.419 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.84 166.24 10.62 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.617 0.767 . . . . 61.21 111.047 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -69.42 142.91 53.75 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 124.214 0.946 . . . . 63.14 110.117 175.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -54.9 -29.25 55.41 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 124.494 1.118 . . . . 71.13 113.429 -173.564 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 90.6 mmm -83.54 -31.72 26.25 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.128 0.571 . . . . 65.01 111.913 -178.584 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' VAL . . . . . 0.545 HG12 HD11 ' A' ' 97' ' ' ILE . 17.9 t -88.23 122.95 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 109.592 -0.521 . . . . 70.21 109.592 -170.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -95.18 152.02 18.71 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.243 0.617 . . . . 61.44 111.281 -166.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -62.3 -26.21 68.29 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.725 0.81 . . . . 73.14 112.683 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -51.74 -33.42 34.62 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.024 0.929 . . . . 72.32 112.487 -178.478 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 43.0 p -91.46 -45.49 8.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.302 0.641 . . . . 74.52 111.416 178.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.545 HD11 HG12 ' A' ' 92' ' ' VAL . 4.9 mt -79.89 -47.15 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 122.409 0.283 . . . . 74.41 110.959 -163.775 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -50.77 -53.17 49.87 Favored Pre-proline 0 N--CA 1.487 1.389 0 N-CA-C 114.845 1.424 . . . . 73.43 114.845 -170.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.32 -36.19 95.09 Favored 'Trans proline' 0 C--N 1.385 2.461 0 C-N-CA 121.784 1.656 . . . . 74.34 112.396 -177.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.421 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 45.2 mt-10 -76.83 -30.84 56.52 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 114.819 -1.082 . . . . 64.01 111.503 -177.138 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.511 HD13 HG13 ' A' ' 86' ' ' ILE . 69.1 mt -66.32 -52.7 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 N-CA-C 109.604 -0.517 . . . . 74.44 109.604 173.015 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ILE . . . . . 0.403 HG23 ' HB ' ' A' ' 19' ' ' ILE . 73.6 mt -57.66 -37.41 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 123.967 0.792 . . . . 72.13 110.745 -178.032 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -58.97 -44.22 91.49 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.931 0.893 . . . . 65.53 111.165 175.543 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 81.8 mt -67.72 -33.35 74.71 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.673 0.789 . . . . 54.12 111.548 177.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.5 HD12 HD11 ' A' ' 63' ' ' LEU . 11.1 mp -70.09 -22.7 63.01 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.14 0.576 . . . . 54.04 110.696 174.225 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.458 ' HA ' ' HB ' ' A' ' 17' ' ' ILE . 25.3 m -82.45 -35.83 27.15 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 109.459 -0.571 . . . . 73.13 109.459 177.653 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -71.87 -64.23 0.98 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.187 0.595 . . . . 64.21 111.798 178.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.453 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 2.8 tt0 -58.79 -48.65 80.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.149 0.579 . . . . 73.21 112.1 -167.181 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.87 -25.46 66.69 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 124.072 0.858 . . . . 55.52 111.919 -176.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.05 -30.1 63.47 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.52 0.728 . . . . 75.53 111.332 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -87.45 -27.44 22.7 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.265 0.626 . . . . 73.2 110.463 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 177.28 123.86 0.81 Allowed Glycine 0 C--N 1.341 0.841 0 N-CA-C 111.492 -0.643 . . . . 54.5 111.492 -176.349 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -26.34 67.86 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.186 0.994 . . . . 73.34 112.118 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -60.59 102.16 0.17 Allowed 'General case' 0 CA--C 1.545 0.781 0 O-C-N 123.507 0.505 . . . . 71.32 110.913 173.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.532 HG13 HG13 ' A' ' 116' ' ' ILE . 8.1 p -61.86 -46.81 95.7 Favored 'Isoleucine or valine' 0 C--N 1.353 0.761 0 N-CA-C 109.365 -0.606 . . . . 74.21 109.365 169.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.532 HG13 HG13 ' A' ' 115' ' ' VAL . 49.0 mt -100.6 83.71 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 106.216 -1.772 . . . . 63.1 106.216 171.341 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 4.4 p -71.67 101.74 2.61 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.258 -1.016 . . . . 70.45 108.258 175.116 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -66.42 -51.15 59.91 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.262 -0.427 . . . . 72.4 111.094 -175.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 . . . . . 0 C--O 1.252 1.202 0 C-N-CA 124.817 1.247 . . . . 74.5 107.714 -179.331 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 ptm . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.544 -0.539 . . . . 72.02 109.544 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.2 80.99 0.05 OUTLIER Glycine 0 C--N 1.346 1.135 0 N-CA-C 111.896 -0.482 . . . . 74.05 111.896 -177.745 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 -82.25 75.35 9.18 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.688 0.795 . . . . 74.15 109.885 -178.428 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -146.64 153.62 40.52 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.713 1.205 . . . . 73.21 109.746 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -159.98 105.87 1.58 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.16 0.984 . . . . 73.32 109.292 -176.83 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -105.73 144.02 33.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.526 0.73 . . . . 55.2 109.731 -177.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -84.5 115.56 22.64 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 108.879 -0.786 . . . . 75.51 108.879 179.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -127.14 131.22 50.81 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.586 0.754 . . . . 74.2 109.874 179.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.4 m -154.16 87.92 1.22 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.514 1.126 . . . . 70.31 108.887 176.427 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -97.39 122.1 40.05 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.258 0.623 . . . . 73.41 109.546 176.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -80.79 69.02 7.25 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.699 0.8 . . . . 73.14 109.964 178.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -77.01 -26.95 54.41 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.062 -0.972 . . . . 72.02 110.96 -177.218 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.0 p -73.9 87.39 1.79 Allowed 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 109.003 -0.74 . . . . 74.31 109.003 170.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -152.41 149.04 28.17 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.352 1.061 . . . . 62.24 109.827 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -102.04 99.8 10.0 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 122.999 0.52 . . . . 74.24 109.677 176.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.452 ' HA ' HG21 ' A' ' 106' ' ' THR . 2.3 pt? -58.48 120.71 9.3 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 123.918 0.761 . . . . 73.44 109.67 174.15 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.2 mt -75.44 135.67 26.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 C-N-CA 124.438 1.095 . . . . 74.24 109.965 -170.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -67.67 115.44 7.25 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.229 1.012 . . . . 72.14 109.91 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 40.8 mm -128.99 114.69 33.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 N-CA-C 105.272 -2.121 . . . . 75.35 105.272 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -100.06 137.14 38.92 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 109.273 -0.64 . . . . 64.02 109.273 -172.544 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.2 m -92.15 120.67 32.97 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.832 0.853 . . . . 73.32 109.852 -176.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 71.1 mt -128.62 137.95 51.94 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.135 0.974 . . . . 75.33 108.819 -179.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 44.5 p -87.55 147.25 25.42 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.018 0.527 . . . . 64.25 110.084 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.5 p -109.96 165.92 11.75 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 108.796 -0.816 . . . . 55.33 108.796 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -66.42 -16.68 52.04 Favored 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.008 1.805 . . . . 71.23 111.849 169.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -79.72 135.28 36.49 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.209 1.003 . . . . 65.22 109.347 178.025 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -80.94 147.91 30.06 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.949 0.5 . . . . 73.21 109.747 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 22.1 m120 55.44 23.91 6.26 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.575 1.15 . . . . 73.2 112.631 -178.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -128.55 121.61 29.18 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 124.742 1.217 . . . . 62.41 107.959 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.6 tp -126.93 125.46 41.58 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.677 -0.49 . . . . 74.12 109.677 -173.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -82.82 107.24 15.29 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.248 1.019 . . . . 71.2 110.462 -177.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -93.46 116.12 28.66 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.203 -1.036 . . . . 75.12 108.203 173.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 43.7 tp -102.75 125.54 49.53 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.52 0.728 . . . . 75.32 109.181 -173.823 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 p -73.71 102.56 4.0 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 107.611 -1.255 . . . . 75.2 107.611 170.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.6 m -82.44 -33.01 28.7 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.981 0.913 . . . . 74.13 111.741 -164.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -60.49 -41.14 93.65 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.337 0.655 . . . . 60.53 111.537 177.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.76 7.43 1.39 Allowed Glycine 0 C--N 1.342 0.872 0 CA-C-O 119.097 -0.835 . . . . 62.54 114.032 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -64.31 151.0 44.99 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 117.67 0.735 . . . . 73.14 109.795 175.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 17.0 ttt -125.88 131.07 52.44 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.453 -0.573 . . . . 65.25 109.453 -178.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.4 mt -95.05 -46.84 6.64 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.432 0.693 . . . . 73.42 111.462 -171.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.435 ' NE2' HG13 ' A' ' 48' ' ' ILE . 6.3 tp-100 -109.88 138.93 45.55 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.028 0.531 . . . . 72.04 110.305 175.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 29.6 m -63.63 125.31 23.87 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 124.493 1.121 . . . . 62.45 108.862 167.813 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -64.15 -22.16 66.83 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 113.478 0.918 . . . . 73.23 113.478 -164.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -92.22 21.52 37.13 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-O 119.697 -0.502 . . . . 72.1 113.547 178.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 26.0 t -132.0 167.75 19.12 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.605 0.762 . . . . 73.42 110.587 -178.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -80.17 155.62 27.34 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.055 0.942 . . . . 75.52 112.103 -174.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.2 m -67.29 107.63 2.45 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.01 0.924 . . . . 73.12 110.147 175.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.435 HG13 ' NE2' ' A' ' 41' ' ' GLN . 39.4 mt -73.85 100.67 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 109.694 -0.484 . . . . 62.53 109.694 -175.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.2 t -84.51 106.67 14.9 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 N-CA-C 107.975 -1.12 . . . . 74.33 107.975 175.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.474 HG23 ' HB3' ' A' ' 57' ' ' LEU . 54.5 mt -95.49 106.87 18.8 Favored 'Isoleucine or valine' 0 C--N 1.34 0.153 0 N-CA-C 107.828 -1.175 . . . . 73.45 107.828 -175.614 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.447 ' HE3' ' HB2' ' A' ' 54' ' ' ASP . 47.1 mtmt -91.64 135.39 33.91 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.161 -0.681 . . . . 72.32 109.161 -177.424 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.444 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 36.1 p30 -63.12 -23.58 67.51 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.169 0.587 . . . . 61.22 111.814 177.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.4 t -80.97 -13.96 58.4 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.898 0.879 . . . . 64.12 111.469 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.447 ' HB2' ' HE3' ' A' ' 51' ' ' LYS . 12.8 t0 -111.38 79.27 1.19 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.116 -1.068 . . . . 65.12 108.116 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -55.58 -32.68 63.26 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 125.627 1.571 . . . . 55.31 113.609 -169.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -62.45 -31.58 72.32 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.076 0.951 . . . . 55.44 111.928 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.474 ' HB3' HG23 ' A' ' 50' ' ' ILE . 75.4 mt -67.77 -35.46 78.74 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.846 0.858 . . . . 75.14 111.518 174.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.98 -48.72 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 108.554 -0.906 . . . . 74.32 108.554 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -54.1 -31.14 51.13 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.803 1.241 . . . . 64.24 112.726 -176.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.5 m170 -86.99 -45.67 10.55 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.059 0.543 . . . . 51.33 110.996 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 22.2 m -87.35 106.1 17.71 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.081 0.553 . . . . 74.43 111.792 -172.246 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.0 ttmm -49.61 -52.2 32.14 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 125.542 1.537 . . . . 74.32 112.726 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.638 HD11 HD12 ' A' ' 105' ' ' LEU . 33.7 tp -61.79 -36.0 79.8 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.699 -1.137 . . . . 71.0 111.451 -177.454 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.429 ' HA ' HD11 ' A' ' 77' ' ' LEU . . . -65.32 -41.3 94.14 Favored 'General case' 0 C--N 1.352 0.703 0 C-N-CA 123.236 0.614 . . . . 75.44 111.161 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 61' ' ' SER . 78.5 mt-30 -56.21 -49.97 72.59 Favored 'General case' 0 C--N 1.352 0.684 0 O-C-N 124.143 0.902 . . . . 74.43 109.901 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.467 ' HB3' HD22 ' A' ' 104' ' ' LEU . 29.5 mm-40 -61.17 -50.75 71.87 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.305 1.042 . . . . 61.45 113.38 179.026 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 74.1 mt -66.17 -46.78 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 C-N-CA 122.839 0.456 . . . . 70.04 111.131 -174.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -70.42 -30.47 67.34 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.867 0.467 . . . . 73.04 112.054 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.9 tp -68.51 -58.79 3.78 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.75 0.42 . . . . 73.34 110.464 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.23 -19.54 56.49 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.563 -0.744 . . . . 71.23 112.015 -175.043 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.496 ' SG ' HG23 ' A' ' 97' ' ' ILE . 63.8 m -139.45 81.32 20.54 Favored Pre-proline 0 CA--C 1.554 1.127 0 N-CA-C 109.103 -0.703 . . . . 72.44 109.103 176.666 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.4 -6.93 16.18 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 122.988 2.459 . . . . 64.43 113.749 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -79.55 -7.37 88.54 Favored Glycine 0 C--N 1.353 1.475 0 CA-C-O 120.016 -0.325 . . . . 72.32 113.124 178.141 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 98.8 t -79.21 130.61 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 123.609 0.764 . . . . 72.4 109.225 172.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . 0.444 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 20.7 mm-40 -87.09 -46.76 9.49 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.145 0.978 . . . . 72.45 111.478 -176.189 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.7 p -157.88 156.53 31.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.697 -0.683 . . . . 73.55 110.838 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LEU . . . . . 0.429 HD11 ' HA ' ' A' ' 64' ' ' ALA . 38.8 mt -108.18 167.21 10.17 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 107.931 -1.137 . . . . 73.32 107.931 171.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.587 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.9 ttm -142.8 103.89 4.26 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 106.871 -1.529 . . . . 70.11 106.871 169.64 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.487 HD13 HD13 ' A' ' 84' ' ' LEU . 28.9 mm -77.21 100.74 2.84 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 N-CA-C 107.73 -1.211 . . . . 73.34 107.73 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.15 173.02 32.63 Favored Glycine 0 C--O 1.241 0.568 0 N-CA-C 110.645 -0.982 . . . . 70.11 110.645 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -55.68 -66.61 0.39 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.901 0.881 . . . . 42.05 110.351 -173.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -105.05 -0.74 26.46 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 114.144 -1.389 . . . . 72.02 110.984 -176.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -137.7 168.16 20.24 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 122.947 0.499 . . . . 74.35 111.709 -166.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.487 HD13 HD13 ' A' ' 79' ' ' ILE . 48.9 tp -139.4 114.19 9.34 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.23 1.012 . . . . 70.15 108.71 176.301 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.587 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 31.0 m -96.13 106.63 18.84 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.481 -0.933 . . . . 74.44 108.481 -178.271 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.532 HG13 HD13 ' A' ' 101' ' ' ILE . 20.2 mm -87.87 117.96 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 108.103 -1.073 . . . . 65.11 108.103 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -104.58 125.7 50.96 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 107.522 -1.288 . . . . 70.43 107.522 174.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.403 ' HA ' ' H ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -134.46 169.89 16.57 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.553 0.741 . . . . 62.52 110.841 -174.911 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -81.37 142.51 32.96 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 115.535 -0.757 . . . . 71.01 109.263 178.792 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -80.25 0.96 30.41 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.893 0.877 . . . . 74.3 112.906 -173.559 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 23.1 ptp -78.34 -22.53 47.9 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 120.679 0.276 . . . . 73.25 110.552 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 18.9 t -102.54 147.35 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 123.743 0.817 . . . . 61.23 109.666 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -76.14 158.67 31.49 Favored 'General case' 0 CA--C 1.564 1.488 0 C-N-CA 124.1 0.96 . . . . 62.22 110.618 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 2.2 m95 -82.04 -56.03 4.2 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.703 0.801 . . . . 72.12 112.179 -179.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -60.8 -18.8 57.54 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 124.563 1.145 . . . . 72.34 112.276 -177.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 71.9 p -77.04 -39.29 50.61 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.673 0.789 . . . . 74.13 110.647 177.788 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.496 HG23 ' SG ' ' A' ' 71' ' ' CYS . 28.8 mt -79.93 -29.55 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.281 0 C-N-CA 123.631 0.772 . . . . 74.33 110.655 178.56 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -57.74 -45.2 99.84 Favored Pre-proline 0 CA--C 1.578 2.029 0 N-CA-C 114.608 1.336 . . . . 74.21 114.608 -169.726 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -62.72 -32.81 78.28 Favored 'Trans proline' 0 C--N 1.398 3.169 0 CA-C-N 122.185 1.816 . . . . 73.35 111.557 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -63.29 -51.25 66.86 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.888 0.875 . . . . 73.55 110.019 174.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.532 HD13 HG13 ' A' ' 86' ' ' ILE . 83.2 mt -58.65 -56.05 19.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.495 0.718 . . . . 74.22 110.684 -178.016 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 67.4 mt -55.61 -39.57 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 C-N-CA 123.727 0.811 . . . . 73.31 111.173 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.72 -50.95 69.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.336 0.654 . . . . 75.41 111.01 178.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.467 HD22 ' HB3' ' A' ' 66' ' ' GLN . 74.4 mt -67.13 -32.7 74.0 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.11 0.964 . . . . 73.32 111.883 -176.705 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.638 HD12 HD11 ' A' ' 63' ' ' LEU . 9.5 mp -69.88 -29.17 66.32 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.683 0.793 . . . . 65.14 109.998 173.555 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.452 HG21 ' HA ' ' A' ' 16' ' ' LEU . 52.4 m -74.94 -45.51 41.93 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 109.689 -0.485 . . . . 71.52 109.689 176.373 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -60.04 -49.89 75.87 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.166 0.986 . . . . 74.25 110.793 -176.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.551 HE21 ' HA ' ' A' ' 115' ' ' VAL . 36.4 tt0 -53.29 -59.2 4.87 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 124.395 1.059 . . . . 73.41 111.065 177.18 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 59.7 mt -72.94 -13.5 61.26 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 114.915 -1.039 . . . . 64.21 111.691 -172.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.36 -27.76 59.29 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.98 0.912 . . . . 74.21 111.143 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -87.41 -43.95 11.71 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.076 0.55 . . . . 75.44 109.571 173.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -178.13 159.21 24.61 Favored Glycine 0 C--N 1.344 0.983 0 CA-C-N 115.544 -0.753 . . . . 51.2 112.587 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -62.08 -29.0 70.01 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.402 1.081 . . . . 61.4 112.426 -178.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -59.9 140.69 56.49 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.233 1.013 . . . . 72.22 112.626 -172.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.551 ' HA ' HE21 ' A' ' 108' ' ' GLN . 8.6 p -85.02 -43.4 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 N-CA-C 108.576 -0.898 . . . . 64.22 108.576 168.342 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 20.4 mt -143.64 96.95 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 N-CA-C 107.416 -1.328 . . . . 72.44 107.416 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.1 p -66.19 -62.54 1.42 Allowed 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.85 0.833 . . . . 74.04 108.805 172.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -137.74 8.53 2.81 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 113.72 -1.582 . . . . 75.43 107.685 158.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 . . . . . 0 CA--C 1.55 0.948 0 C-N-CA 126.441 1.897 . . . . 75.34 106.614 -169.594 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 mpp? . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.484 -0.562 . . . . 74.01 109.484 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 129.85 105.13 1.12 Allowed Glycine 0 C--N 1.353 1.49 0 N-CA-C 111.859 -0.497 . . . . 72.1 111.859 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -144.09 106.59 4.41 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.131 0.972 . . . . 73.23 109.318 176.238 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -74.85 124.78 27.48 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.069 0.548 . . . . 71.01 109.665 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 61.6 m80 -93.04 105.66 17.72 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 107.98 -1.119 . . . . 64.32 107.98 175.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -66.11 111.25 3.31 Favored 'General case' 0 C--O 1.243 0.745 0 O-C-N 123.765 0.666 . . . . 63.44 109.96 -176.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -61.54 124.36 20.43 Favored 'General case' 0 C--N 1.348 0.514 0 O-C-N 124.234 0.959 . . . . 64.22 108.807 174.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 21.1 m80 -84.13 166.24 17.8 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 123.837 0.855 . . . . 74.01 109.962 -173.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.1 t -61.74 126.16 26.36 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 108.939 -0.763 . . . . 61.33 108.939 172.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -72.79 78.88 1.12 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.229 0.612 . . . . 74.13 110.256 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ttt -77.38 114.77 16.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.64 -0.709 . . . . 74.44 110.264 -175.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -124.17 35.19 4.87 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.418 1.087 . . . . 64.24 109.356 179.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.4 m -78.19 4.78 11.71 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.743 -1.117 . . . . 75.02 112.443 -173.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -62.48 87.45 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.367 1.067 . . . . 73.41 110.588 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -113.6 69.83 0.71 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.41 -0.959 . . . . 72.24 108.41 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -161.37 163.76 30.44 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.353 -1.294 . . . . 71.35 109.137 175.006 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 75.8 mt -94.91 130.0 44.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 107.778 -1.193 . . . . 64.34 107.778 174.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -75.69 112.38 12.0 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.433 0.693 . . . . 72.12 109.877 -169.098 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 44.8 mm -119.97 112.23 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 107.717 -1.216 . . . . 73.12 107.717 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.2 ttmm -91.99 126.55 37.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.932 0.893 . . . . 72.24 109.514 -173.079 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.9 m -90.28 120.6 31.56 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 108.837 -0.801 . . . . 71.11 108.837 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.415 ' HB2' ' HG3' ' A' ' 31' ' ' LYS . 97.7 mt -128.04 139.6 52.44 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.043 0.937 . . . . 62.24 109.071 -179.232 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 72.4 p -83.68 160.94 21.22 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.166 0.586 . . . . 74.44 110.192 177.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 43.1 p -115.77 162.25 26.36 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 108.664 -0.865 . . . . 74.21 108.664 175.558 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -58.37 -16.35 28.45 Favored 'Trans proline' 0 C--N 1.377 2.027 0 C-N-CA 122.844 2.363 . . . . 72.33 113.37 167.082 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.445 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 28.0 t-20 -84.26 151.02 25.05 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.308 0.643 . . . . 64.52 110.723 176.34 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -67.04 -52.85 37.25 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 124.304 1.042 . . . . 62.13 112.594 -176.824 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -106.97 18.72 21.44 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.678 0.791 . . . . 73.23 111.253 -168.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.445 ' HB3' ' HB3' ' A' ' 26' ' ' ASN . . . -111.94 128.34 56.13 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.535 0.734 . . . . 34.43 109.272 177.15 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.9 tp -137.56 116.23 12.16 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 107.296 -1.372 . . . . 72.33 107.296 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 85' ' ' THR . 60.9 pttt -94.87 150.07 20.57 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.442 0.639 . . . . 74.14 111.194 -176.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -124.32 122.52 37.94 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.569 1.147 . . . . 60.23 108.113 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 26.7 tp -104.12 126.64 51.39 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 124.003 0.921 . . . . 72.01 109.613 -165.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.5 p -85.24 106.56 16.75 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.424 0.689 . . . . 65.33 109.142 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.6 p -96.14 -8.42 33.27 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.385 0.674 . . . . 63.03 112.66 -170.008 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.32 -32.8 37.91 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.75 0.82 . . . . 74.15 112.858 -169.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 121.41 -23.1 7.68 Favored Glycine 0 N--CA 1.475 1.248 0 N-CA-C 111.048 -0.821 . . . . 71.32 111.048 -171.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -68.06 96.76 0.64 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.456 -0.942 . . . . 75.15 108.456 168.08 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.8 ttt -79.71 139.24 37.41 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.593 0.757 . . . . 73.43 109.194 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.579 HD23 HD21 ' A' ' 109' ' ' LEU . 87.9 mt -60.1 -34.55 73.63 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.202 0.601 . . . . 63.45 112.2 -178.01 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLN . . . . . 0.58 HE22 HD12 ' A' ' 48' ' ' ILE . 25.6 tt0 -175.1 157.57 2.31 Favored 'General case' 0 C--O 1.24 0.583 0 O-C-N 124.3 1.0 . . . . 65.22 109.672 -177.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.2 t -50.11 144.85 6.47 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.61 1.164 . . . . 60.22 111.907 173.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 35.2 ptt-85 -65.35 -16.67 63.83 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.82 -1.082 . . . . 62.42 112.111 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.99 -13.76 53.77 Favored Glycine 0 C--N 1.359 1.837 0 N-CA-C 114.654 0.621 . . . . 71.24 114.654 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 76.7 p -75.06 161.61 29.28 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.325 0.65 . . . . 51.35 110.146 171.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.36 73.14 1.44 Allowed 'General case' 0 N--CA 1.488 1.46 0 CA-C-O 121.432 0.634 . . . . 72.11 111.772 -174.222 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.2 m 51.85 69.33 0.68 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.286 1.034 . . . . 72.24 111.488 -178.512 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.58 HD12 HE22 ' A' ' 41' ' ' GLN . 57.6 mt -75.85 99.21 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.587 -0.523 . . . . 62.41 109.587 -175.57 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 94.0 t -80.25 124.2 37.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 108.196 -1.038 . . . . 65.41 108.196 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.542 HD11 HD11 ' A' ' 116' ' ' ILE . 45.7 mt -105.02 109.37 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 108.29 -1.004 . . . . 72.44 108.29 -179.468 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -79.6 140.2 37.22 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.736 -0.468 . . . . 73.44 109.736 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -65.75 -23.83 66.82 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.784 0.433 . . . . 75.55 111.388 176.106 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -85.58 -19.61 30.8 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.725 0.81 . . . . 61.21 111.791 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -92.35 95.39 9.65 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 108.572 -0.899 . . . . 73.23 108.572 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -53.08 -40.15 63.85 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.369 1.068 . . . . 72.23 113.023 178.185 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -67.43 -44.15 79.43 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.514 0.726 . . . . 73.31 112.162 -169.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 97.7 mt -61.84 -35.09 77.25 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.464 0.706 . . . . 53.02 111.31 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.507 HG22 ' HG2' ' A' ' 65' ' ' GLN . 53.7 mt -77.71 -34.0 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 CA-C-N 115.068 -0.969 . . . . 72.33 110.205 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -59.62 -36.44 76.32 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.181 0.592 . . . . 70.3 111.268 174.1 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.7 m170 -74.75 -39.23 61.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.499 0.72 . . . . 64.02 111.117 178.242 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.559 ' HB2' HD13 ' A' ' 116' ' ' ILE . 43.7 t -104.45 98.78 8.51 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.431 0.692 . . . . 73.25 110.646 -176.873 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -61.13 -32.31 72.01 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.939 0.496 . . . . 73.5 110.659 173.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.0 tp -58.27 -40.33 81.56 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.024 0.93 . . . . 64.41 110.713 174.056 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.04 -40.93 91.42 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.209 0.604 . . . . 64.13 111.544 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.507 ' HG2' HG22 ' A' ' 58' ' ' ILE . 91.9 mt-30 -55.68 -47.08 77.35 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.901 0.751 . . . . 73.33 110.162 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -62.99 -51.03 68.44 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.956 -1.02 . . . . 72.31 112.84 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -65.05 -45.83 93.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.062 0.545 . . . . 64.35 111.291 -174.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -69.37 -33.06 72.49 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.791 0.436 . . . . 71.02 112.053 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 52.8 tp -70.99 -42.69 69.32 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.709 0.404 . . . . 74.43 111.192 177.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLN . . . . . 0.451 HE22 HD21 ' A' ' 104' ' ' LEU . 78.7 mt-30 -74.95 -26.67 59.77 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.164 0.586 . . . . 72.44 111.475 -178.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.5 t -146.88 103.58 3.88 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 122.826 0.45 . . . . 74.03 110.074 178.42 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -78.73 7.23 4.36 Favored 'Trans proline' 0 C--N 1.373 1.866 0 C-N-CA 122.757 2.305 . . . . 63.54 112.928 173.862 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -78.51 -25.76 60.39 Favored Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.149 -0.38 . . . . 71.44 112.149 171.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 42.2 t -69.43 121.96 19.97 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.186 0.594 . . . . 52.14 110.167 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -74.49 -48.33 27.89 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.252 1.021 . . . . 74.24 110.538 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 62.0 p -162.81 166.42 24.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.607 -1.178 . . . . 62.22 110.326 -173.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.2 mt -111.69 169.86 8.54 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.0 -1.111 . . . . 75.32 108.0 171.322 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.528 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 56.0 ttm -143.14 115.43 8.46 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.517 -1.29 . . . . 72.35 107.517 170.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.541 HD13 HD13 ' A' ' 84' ' ' LEU . 42.7 mm -84.89 104.64 13.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 107.943 -1.132 . . . . 51.53 107.943 179.333 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -85.46 173.31 47.75 Favored Glycine 0 C--O 1.244 0.751 0 N-CA-C 109.442 -1.463 . . . . 52.13 109.442 167.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.32 -52.39 64.88 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.224 0.61 . . . . 64.22 110.724 -176.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -123.96 5.06 8.67 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 115.368 -0.833 . . . . 73.34 111.879 -176.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -140.2 133.92 30.41 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.982 0.513 . . . . 74.1 110.379 -175.045 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.663 HD23 HD11 ' A' ' 105' ' ' LEU . 32.8 tp -103.27 114.61 29.03 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 109.445 -0.576 . . . . 60.44 109.445 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.528 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 18.4 m -97.81 113.27 25.02 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.35 0.66 . . . . 73.31 109.558 -177.429 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.608 HG13 HD13 ' A' ' 101' ' ' ILE . 30.1 mm -89.01 128.35 41.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 108.307 -0.997 . . . . 74.44 108.307 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -117.94 110.94 18.33 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 108.366 -0.976 . . . . 71.43 108.366 -177.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' LYS . . . . . 0.497 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -117.26 174.28 6.21 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.053 0.541 . . . . 72.41 111.332 -174.467 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -74.02 131.71 41.65 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 108.511 -0.922 . . . . 61.11 108.511 172.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -56.35 -30.37 62.56 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.958 1.096 . . . . 73.3 113.958 -172.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.7 mtp -76.79 -9.33 58.6 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.98 0.512 . . . . 73.41 112.228 -176.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 39.6 t -95.77 138.62 20.86 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.323 1.049 . . . . 54.42 108.475 176.212 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -79.46 160.5 26.56 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.349 0.66 . . . . 75.34 111.165 -176.216 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 22.7 m95 -80.3 -51.87 8.38 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.115 0.566 . . . . 72.23 112.124 176.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -60.9 -18.19 55.05 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.786 0.834 . . . . 70.44 112.663 -171.753 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.9 m -71.46 -49.68 39.1 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.335 0.654 . . . . 62.14 110.717 175.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 6.7 mt -85.23 -31.1 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 CA-C-N 115.234 -0.893 . . . . 73.23 111.043 -173.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.2 ttpm? -53.66 -50.11 85.18 Favored Pre-proline 0 CA--C 1.559 1.309 0 C-N-CA 124.566 1.146 . . . . 74.13 113.993 -167.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -58.96 -35.86 97.85 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 122.014 1.81 . . . . 75.33 112.329 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.93 -37.86 82.18 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.601 -0.727 . . . . 74.11 110.668 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.608 HD13 HG13 ' A' ' 86' ' ' ILE . 69.3 mt -65.51 -54.05 32.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 123.676 0.79 . . . . 70.24 109.677 177.564 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 87.3 mt -54.32 -39.34 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 124.053 0.941 . . . . 62.24 111.317 -177.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.13 -49.1 75.74 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 115.087 -0.96 . . . . 72.15 111.3 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.451 HD21 HE22 ' A' ' 70' ' ' GLN . 95.0 mt -65.49 -33.46 76.0 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.75 0.82 . . . . 61.43 112.471 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.663 HD11 HD23 ' A' ' 84' ' ' LEU . 9.7 mp -71.78 -27.26 62.83 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.251 0.62 . . . . 53.2 111.324 175.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.1 m -72.28 -32.47 66.65 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 109.379 -0.601 . . . . 73.13 109.379 173.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.454 ' HE2' ' HA ' ' A' ' 107' ' ' LYS . 9.1 mmpt? -69.28 -45.62 69.21 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.454 0.701 . . . . 64.24 111.105 177.513 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.599 HE21 ' HB ' ' A' ' 115' ' ' VAL . 1.1 tm0? -61.12 -54.24 47.02 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.902 0.881 . . . . 64.41 109.314 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' LEU . . . . . 0.579 HD21 HD23 ' A' ' 40' ' ' LEU . 97.7 mt -74.37 -14.67 60.9 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 114.729 -1.123 . . . . 73.53 112.26 -174.28 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.59 -35.81 78.89 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.993 0.517 . . . . 64.32 110.355 171.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' TYR . . . . . 0.502 ' HB2' ' HG2' ' A' ' 113' ' ' GLU . 93.0 m-85 -87.09 -34.6 19.08 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.486 -0.779 . . . . 64.2 109.713 171.29 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 79.78 52.02 4.87 Favored Glycine 0 C--N 1.349 1.292 0 N-CA-C 110.685 -0.966 . . . . 51.52 110.685 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLU . . . . . 0.502 ' HG2' ' HB2' ' A' ' 111' ' ' TYR . 32.5 mm-40 -82.35 154.73 25.11 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.521 0.728 . . . . 75.34 112.412 -172.301 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -89.05 98.72 11.92 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 106.202 -1.777 . . . . 73.24 106.202 159.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.599 ' HB ' HE21 ' A' ' 108' ' ' GLN . 3.5 p -43.58 -42.88 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 C-N-CA 125.653 1.581 . . . . 75.21 114.677 -168.556 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.559 HD13 ' HB2' ' A' ' 61' ' ' SER . 43.5 mm -96.46 -71.63 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.366 0.666 . . . . 74.4 109.984 -178.169 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.4 m -145.55 136.12 24.24 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.247 1.019 . . . . 71.31 109.189 -174.565 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -92.35 -39.99 11.16 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.779 0.831 . . . . 60.1 109.57 179.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.556 1.181 0 C-N-CA 123.991 0.916 . . . . 73.33 109.041 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.44 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 pmm? . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 109.527 -0.545 . . . . 70.43 109.527 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -155.63 82.05 0.16 Allowed Glycine 0 C--N 1.348 1.244 0 N-CA-C 112.175 -0.37 . . . . 73.12 112.175 -176.138 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -108.98 19.32 19.7 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.681 0.792 . . . . 75.54 110.178 175.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -63.91 129.37 39.78 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.616 1.166 . . . . 70.14 111.125 -175.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.7 m170 -77.04 141.2 40.41 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.62 0.768 . . . . 74.14 110.299 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -62.23 -52.26 64.48 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.942 0.897 . . . . 75.23 109.818 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 40.29 79.8 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 O-C-N 125.376 1.673 . . . . 73.2 112.698 170.749 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -85.35 27.71 0.79 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.692 1.197 . . . . 74.55 111.728 -167.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.9 p -66.99 96.27 0.42 Allowed 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 123.613 0.765 . . . . 70.33 110.428 178.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -76.8 81.43 3.4 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 108.894 -0.78 . . . . 63.23 108.894 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 18.4 ttt -75.76 106.09 7.14 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.753 -0.658 . . . . 75.45 109.976 -179.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -76.95 128.0 33.73 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 108.01 -1.108 . . . . 71.43 108.01 167.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.0 m -117.18 -9.45 11.0 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.983 0.913 . . . . 64.34 110.273 177.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -77.58 171.18 15.32 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 124.361 1.064 . . . . 61.33 111.334 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 60.94 36.61 18.72 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.7 1.2 . . . . 70.03 110.613 -166.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.48 ' H ' HD23 ' A' ' 16' ' ' LEU . 1.2 pt? -79.89 82.0 6.06 Favored 'General case' 0 C--N 1.356 0.849 0 CA-C-O 123.483 1.611 . . . . 74.43 108.148 169.499 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.488 ' H ' HG23 ' A' ' 106' ' ' THR . 85.6 mt -67.82 105.37 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 112.489 -2.141 . . . . 74.33 109.431 -176.547 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -67.61 127.98 34.74 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 114.591 -1.186 . . . . 74.22 109.761 -173.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.1 mm -119.95 118.71 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 106.491 -1.67 . . . . 60.33 106.491 -175.467 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -95.06 129.75 42.03 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.23 -1.026 . . . . 71.44 108.23 -175.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.6 t -100.56 130.86 46.68 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.489 0.716 . . . . 50.5 109.379 -178.079 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.1 mt -126.67 138.82 53.47 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.377 1.071 . . . . 74.23 108.668 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 40.1 p -73.71 149.2 42.01 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.458 0.703 . . . . 61.03 110.897 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 72.6 p -122.89 167.57 14.15 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.819 1.248 . . . . 64.12 108.028 -176.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' PRO . . . . . 0.425 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 17.9 Cg_endo -56.78 -18.19 26.1 Favored 'Trans proline' 0 C--N 1.39 2.735 0 C-N-CA 122.364 2.042 . . . . 65.51 113.426 177.645 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -109.61 133.24 53.33 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.602 0.761 . . . . 71.4 109.466 176.454 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.33 -21.76 62.88 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.283 0.633 . . . . 71.13 110.185 166.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -59.95 -47.23 86.65 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.608 1.563 . . . . 73.03 110.469 173.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.55 160.52 15.0 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 114.3 -1.318 . . . . 52.15 110.181 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.0 tp -158.18 128.55 6.17 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.787 -0.82 . . . . 75.03 108.787 173.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -82.37 127.01 32.83 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.988 0.915 . . . . 73.23 110.358 -176.164 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PHE . . . . . 0.45 ' CZ ' ' HG3' ' A' ' 98' ' ' LYS . 80.1 m-85 -114.75 116.71 29.09 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.562 1.145 . . . . 73.54 108.344 175.058 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.0 tp -114.8 129.96 56.78 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 124.069 0.948 . . . . 74.2 109.33 -169.693 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.8 t -100.02 103.87 15.43 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 108.126 -1.064 . . . . 42.35 108.126 174.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.0 p -104.24 -6.61 20.76 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.096 0.958 . . . . 73.42 109.754 176.262 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.85 -60.42 3.68 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 124.648 1.179 . . . . 70.3 111.725 -168.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -161.1 -81.54 0.04 OUTLIER Glycine 0 C--N 1.338 0.678 0 N-CA-C 111.114 -0.794 . . . . 52.14 111.114 176.748 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.21 119.91 17.08 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.471 0.708 . . . . 42.34 109.659 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 48.4 ttp -97.38 155.61 16.83 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.04 -0.982 . . . . 73.42 109.332 -176.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.1 mt -58.68 -62.29 1.97 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.115 1.154 . . . . 74.51 114.115 -169.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 40.9 tt0 -114.84 -91.9 0.51 Allowed 'General case' 0 N--CA 1.484 1.235 0 CA-C-O 119.233 -0.413 . . . . 52.01 110.693 -174.086 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 10.6 t 176.44 155.65 0.23 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.504 1.122 . . . . 63.55 109.724 -177.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -71.52 150.22 45.03 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.511 0.324 . . . . 70.21 110.421 172.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 91.08 12.15 60.53 Favored Glycine 0 C--N 1.344 1.008 0 CA-C-N 116.151 -0.477 . . . . 73.41 112.447 -175.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.1 t -93.03 179.59 5.39 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.577 1.151 . . . . 63.33 110.623 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.06 -179.02 5.16 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.185 0.994 . . . . 74.54 109.635 176.19 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.8 m -74.61 93.98 2.6 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.435 0.694 . . . . 54.25 110.604 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.506 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 46.6 mt -81.44 97.07 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 N-CA-C 109.126 -0.694 . . . . 65.53 109.126 175.621 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.1 t -84.21 107.87 15.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 108.48 -0.933 . . . . 62.42 108.48 -178.278 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ILE . . . . . 0.506 HG23 ' HB2' ' A' ' 57' ' ' LEU . 55.5 mt -105.61 109.51 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 107.138 -1.43 . . . . 75.12 107.138 174.401 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -93.48 171.62 8.79 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.507 -0.553 . . . . 63.44 109.507 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -56.75 -25.74 55.61 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.248 1.019 . . . . 73.42 112.638 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.8 t -87.12 -17.07 33.64 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.031 0.932 . . . . 64.24 111.466 -178.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -84.17 60.09 5.72 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.407 0.683 . . . . 74.14 110.43 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -61.27 -24.54 66.46 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.278 1.031 . . . . 72.43 111.577 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -56.18 -51.87 66.44 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.851 0.861 . . . . 73.11 110.218 172.307 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.506 ' HB2' HG23 ' A' ' 50' ' ' ILE . 21.8 mt -78.58 -34.95 46.5 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 114.312 -1.313 . . . . 64.22 110.194 -172.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 78.5 mt -62.88 -47.43 92.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.86 0.864 . . . . 71.14 110.619 176.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -66.29 -15.63 63.37 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.823 0.675 . . . . 62.04 112.823 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -87.64 -8.86 55.65 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.726 0.411 . . . . 71.55 111.955 173.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.1 t -130.39 102.18 6.07 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.579 0.752 . . . . 75.44 109.175 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -58.49 -28.37 65.33 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.106 0.562 . . . . 65.24 110.627 176.33 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.631 HD11 HD12 ' A' ' 105' ' ' LEU . 40.2 tp -62.35 -48.06 81.48 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.501 0.501 . . . . 73.45 110.358 174.549 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.81 -45.33 90.18 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 124.075 0.859 . . . . 75.11 110.075 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -57.74 -44.31 85.98 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 124.357 1.036 . . . . 71.12 111.018 178.164 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.448 ' HB3' HD22 ' A' ' 104' ' ' LEU . 92.8 mm-40 -68.31 -36.32 79.15 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.339 0.656 . . . . 63.01 112.308 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 93.3 mt -67.77 -46.79 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.077 0.551 . . . . 72.43 109.984 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -71.4 -21.73 61.96 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 123.272 0.629 . . . . 63.41 111.694 176.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.11 -53.1 7.76 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.265 0.626 . . . . 65.33 110.491 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 27.9 mt-30 -84.95 -17.74 36.78 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.541 -0.754 . . . . 72.13 111.525 -174.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' CYS . . . . . 0.504 ' SG ' HG23 ' A' ' 97' ' ' ILE . 62.2 m -141.34 90.13 9.18 Favored Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 123.251 0.621 . . . . 55.31 109.602 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -75.31 -1.6 11.5 Favored 'Trans proline' 0 C--N 1.374 1.905 0 C-N-CA 122.784 2.323 . . . . 61.44 113.1 178.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.07 -22.58 77.68 Favored Glycine 0 C--N 1.351 1.388 0 N-CA-C 111.692 -0.563 . . . . 71.33 111.692 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.2 t -65.79 121.56 15.09 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 C-N-CA 123.74 0.816 . . . . 65.11 110.098 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -91.08 -40.34 11.67 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.334 1.054 . . . . 63.21 110.436 -176.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.2 t -154.18 160.52 41.91 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.595 0.712 . . . . 55.33 111.501 -175.159 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 mt -126.65 138.21 53.39 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.053 1.741 . . . . 75.24 106.803 174.07 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' MET . . . . . 0.417 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 49.9 ttm -116.66 104.63 11.57 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 108.311 -0.996 . . . . 51.31 108.311 172.376 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ILE . . . . . 0.772 HD13 HD13 ' A' ' 84' ' ' LEU . 10.6 mm -84.01 112.37 21.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 107.778 -1.193 . . . . 73.04 107.778 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -96.95 -158.2 31.19 Favored Glycine 0 C--O 1.242 0.627 0 N-CA-C 111.754 -0.538 . . . . 61.4 111.754 177.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.56 -62.1 1.52 Allowed 'General case' 0 C--O 1.244 0.77 0 C-N-CA 123.796 0.838 . . . . 70.25 109.301 174.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.87 -29.81 12.75 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 113.858 -1.519 . . . . 74.34 111.05 -174.709 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -114.64 173.19 6.59 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.275 -0.875 . . . . 72.55 113.182 -160.418 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LEU . . . . . 0.772 HD13 HD13 ' A' ' 79' ' ' ILE . 14.7 tp -144.79 117.4 8.62 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.576 1.55 . . . . 74.04 107.719 175.356 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 11.3 m -103.62 109.52 21.24 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.914 -0.773 . . . . 60.23 108.914 -175.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.587 HG13 HD13 ' A' ' 101' ' ' ILE . 18.6 mm -88.46 117.28 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 108.708 -0.849 . . . . 62.14 108.708 -176.594 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -101.96 128.74 48.24 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 107.79 -1.189 . . . . 71.12 107.79 174.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.83 169.91 16.96 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.659 0.384 . . . . 51.22 110.389 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.18 126.81 28.62 Favored 'General case' 0 C--N 1.35 0.609 0 N-CA-C 109.236 -0.654 . . . . 55.34 109.236 178.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.6 ptm85 -65.41 -23.17 66.88 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.475 0.917 . . . . 75.52 113.475 -169.052 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.6 mmt -79.19 -21.49 46.29 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.921 0.488 . . . . 74.24 110.937 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.0 t -88.02 145.57 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 108.08 -1.082 . . . . 74.44 108.08 174.442 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -106.95 144.06 34.14 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 112.895 0.702 . . . . 73.41 112.895 -167.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -61.72 -22.99 65.84 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.543 1.137 . . . . 65.44 112.199 174.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -53.42 -32.9 51.79 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.397 1.079 . . . . 74.34 112.119 -178.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.7 t -103.45 -20.79 13.93 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.859 0.864 . . . . 74.53 111.579 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ILE . . . . . 0.504 HG23 ' SG ' ' A' ' 71' ' ' CYS . 55.5 mt -97.48 -53.65 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 122.886 0.474 . . . . 71.31 111.344 -170.259 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.45 ' HG3' ' CZ ' ' A' ' 32' ' ' PHE . 3.8 ttpm? -52.48 -47.77 92.3 Favored Pre-proline 0 N--CA 1.49 1.565 0 N-CA-C 114.026 1.121 . . . . 75.23 114.026 -173.053 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.33 -40.98 82.71 Favored 'Trans proline' 0 C--N 1.394 2.972 0 C-N-CA 122.121 1.881 . . . . 71.51 112.205 177.282 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 11.2 mm-40 -69.58 -38.05 77.19 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 115.483 -0.781 . . . . 70.34 110.36 -177.515 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.587 HD13 HG13 ' A' ' 86' ' ' ILE . 86.2 mt -60.1 -52.28 63.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.31 0.644 . . . . 70.12 110.322 176.731 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 79.6 mt -56.91 -39.24 63.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.462 0.705 . . . . 42.11 111.026 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -64.25 -42.35 96.54 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.147 0.979 . . . . 71.52 111.33 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.524 HD23 ' HE2' ' A' ' 107' ' ' LYS . 89.6 mt -64.7 -43.67 92.74 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.497 0.719 . . . . 72.14 110.765 176.71 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' LEU . . . . . 0.631 HD12 HD11 ' A' ' 63' ' ' LEU . 11.0 mp -66.88 -24.9 66.17 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.728 0.811 . . . . 71.1 111.164 178.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.488 HG23 ' H ' ' A' ' 17' ' ' ILE . 82.9 m -77.39 -48.93 16.0 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.448 0.699 . . . . 65.52 110.42 178.439 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.524 ' HE2' HD23 ' A' ' 104' ' ' LEU . 0.1 OUTLIER -68.14 -40.36 82.47 Favored 'General case' 0 C--N 1.358 0.968 0 O-C-N 123.337 0.398 . . . . 72.52 110.969 -174.16 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 108' ' ' GLN . . . . . 0.621 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 20.7 tt0 -55.84 -58.71 6.73 Favored 'General case' 0 C--N 1.358 0.938 0 O-C-N 123.916 0.76 . . . . 65.42 110.35 177.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 86.8 mt -71.64 -10.8 60.31 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 114.841 -1.072 . . . . 72.44 111.764 -173.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.71 -37.1 70.69 Favored 'General case' 0 C--N 1.354 0.801 0 C-N-CA 123.269 0.628 . . . . 72.01 111.173 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -110.39 -19.14 13.06 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.143 0.577 . . . . 52.21 111.953 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -119.8 163.11 13.8 Favored Glycine 0 C--N 1.339 0.729 0 N-CA-C 111.016 -0.834 . . . . 54.21 111.016 -176.873 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -102.88 -24.19 13.7 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.356 0.662 . . . . 73.01 110.168 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -114.27 158.84 20.87 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.787 0.835 . . . . 75.2 111.474 -167.779 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' VAL . . . . . 0.53 HG13 HG13 ' A' ' 116' ' ' ILE . 5.8 p -83.14 -44.15 18.64 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 123.891 0.877 . . . . 74.13 111.123 174.829 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' ILE . . . . . 0.533 HD11 HG13 ' A' ' 79' ' ' ILE . 68.6 mt -112.49 -32.01 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 124.128 0.971 . . . . 61.22 110.24 -177.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.7 m 68.61 45.04 1.12 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.363 1.065 . . . . 73.45 109.057 -164.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -78.73 83.75 4.86 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 113.831 -1.531 . . . . 71.23 107.876 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 . . . . . 0 CA--C 1.561 1.37 0 C-N-CA 125.002 1.321 . . . . 75.04 111.783 -176.512 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 66.9 mt . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 107.478 -1.305 . . . . 55.530000000000001 107.478 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -64.88 124.7 22.7 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 123.75 0.656 . . . . 74.420000000000002 109.725 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.444 ' HB ' HG23 ' A' ' 102' ' ' ILE . 50.3 mm -116.03 127.37 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 N-CA-C 107.313 -1.366 . . . . 73.530000000000001 107.313 -174.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -93.63 150.13 20.67 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 108.494 -0.928 . . . . 71.420000000000002 108.494 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.9 t -141.28 112.23 7.22 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.695 0.798 . . . . 30.219999999999999 109.233 173.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.8 mt -99.65 138.97 35.99 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 124.075 0.95 . . . . 72.319999999999993 110.33 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.0 p -80.22 140.2 36.38 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 123.748 0.655 . . . . 72.340000000000003 109.453 176.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 63.9 p -107.09 166.08 11.7 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.539 1.136 . . . . 73.340000000000003 108.712 -176.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.71 -7.93 19.67 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.375 2.05 . . . . 75.120000000000005 112.743 169.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -82.65 151.14 26.42 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.222 1.009 . . . . 74.329999999999998 111.628 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -89.4 -31.58 17.68 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.086 0.954 . . . . 72.120000000000005 112.357 -171.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -121.82 2.3 9.99 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.269 0.627 . . . . 75.310000000000002 111.921 -174.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -112.54 137.53 50.64 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.91 0.484 . . . . 61.43 110.121 177.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.4 tp -136.99 134.59 36.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.993 0.517 . . . . 72.530000000000001 109.958 177.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.599 ' HE2' HD12 ' A' ' 33' ' ' LEU . 88.6 tttt -92.2 120.34 32.68 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.296 1.038 . . . . 72.129999999999995 110.629 -175.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -109.81 109.04 19.58 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.296 -1.002 . . . . 73.319999999999993 108.296 173.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.599 HD12 ' HE2' ' A' ' 31' ' ' LYS . 4.5 tt -111.94 134.18 53.66 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.366 -0.976 . . . . 72.329999999999998 108.366 -175.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.3 m -85.93 111.96 20.73 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.278 0.631 . . . . 63.25 110.006 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.523 HG23 HD22 ' A' ' 33' ' ' LEU . 26.3 p -135.21 90.94 2.68 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.838 0.855 . . . . 72.310000000000002 110.284 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -174.26 -58.59 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.168 0.587 . . . . 55.049999999999997 110.717 176.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.53 -72.32 0.03 OUTLIER Glycine 0 C--N 1.342 0.912 0 CA-C-N 115.695 -0.684 . . . . 63.439999999999998 111.528 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.425 ' HB2' ' HB3' ' A' ' 109' ' ' LEU . 25.0 mm-40 -99.74 167.1 10.77 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.182 0.515 . . . . 52.140000000000001 111.195 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 24.1 ptm -131.44 167.66 18.94 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.07 1.348 . . . . 71.530000000000001 108.672 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.416 HD23 HD21 ' A' ' 109' ' ' LEU . 90.2 mt -75.51 -66.69 0.74 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 122.738 0.415 . . . . 75.299999999999997 111.191 -173.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 . . . . . 0 N--CA 1.478 0.972 0 C-N-CA 123.264 0.626 . . . . 63.439999999999998 109.426 -172.018 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.3 m . . . . . 0 CA--C 1.546 0.794 0 N-CA-C 110.097 -0.334 . . . . 72.439999999999998 110.097 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 23.1 pttm -109.26 162.06 14.66 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.743 0.417 . . . . 63.219999999999999 110.712 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' A' ' 79' ' ' ILE . 17.9 p -83.37 97.01 8.71 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.393 0.677 . . . . 44.340000000000003 109.555 175.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 56.9 mt -86.06 121.2 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.919 0.888 . . . . 70.109999999999999 110.58 -174.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -89.5 108.65 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 N-CA-C 109.591 -0.522 . . . . 72.030000000000001 109.591 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 60.7 mt -97.16 110.2 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.915 -0.772 . . . . 71.219999999999999 108.915 -176.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -93.74 151.93 19.29 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.288 0.635 . . . . 71.420000000000002 110.059 -175.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.466 ' HA ' HD11 ' A' ' 58' ' ' ILE . 9.1 p30 -66.36 -22.68 66.26 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.722 0.409 . . . . 71.400000000000006 111.483 178.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.4 p -83.35 -32.81 26.05 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.578 0.751 . . . . 64.0 110.726 176.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.4 75.06 9.84 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.816 0.846 . . . . 75.420000000000002 109.513 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -64.52 -28.58 69.75 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 114.625 -1.17 . . . . 63.399999999999999 113.588 -172.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -60.69 -38.29 84.5 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.584 0.629 . . . . 63.210000000000001 110.814 -179.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 78.5 mt -69.78 -38.5 76.73 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.421 0.688 . . . . 74.519999999999996 110.953 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.507 HG22 ' HG2' ' A' ' 65' ' ' GLN . 52.2 mt -62.65 -46.26 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.939 0.896 . . . . 50.329999999999998 110.246 175.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -58.86 -31.41 68.52 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.645 1.178 . . . . 63.229999999999997 111.692 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -70.36 -34.29 72.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.248 0.619 . . . . 74.409999999999997 111.463 177.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.2 t -113.17 105.04 12.97 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.479 0.712 . . . . 70.200000000000003 110.154 -175.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -56.98 -31.89 65.51 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.414 0.686 . . . . 71.430000000000007 110.748 174.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.477 HD11 HD12 ' A' ' 105' ' ' LEU . 43.9 tp -63.14 -44.52 95.31 Favored 'General case' 0 C--N 1.348 0.538 0 C-N-CA 124.095 0.958 . . . . 71.439999999999998 110.535 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.71 97.06 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 123.272 0.629 . . . . 71.019999999999996 110.698 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.507 ' HG2' HG22 ' A' ' 58' ' ' ILE . 68.9 mt-30 -56.93 -44.53 82.57 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 124.355 1.035 . . . . 71.239999999999995 110.846 177.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.409 HE21 ' NE2' ' A' ' 70' ' ' GLN . 18.8 mm100 -68.32 -36.78 79.81 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.434 0.693 . . . . 64.510000000000005 111.987 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 81.3 mt -68.72 -48.67 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.28 0.632 . . . . 64.400000000000006 111.027 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -66.97 -30.6 70.77 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.693 0.397 . . . . 72.140000000000001 111.289 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.5 tp -72.37 -52.41 16.19 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.198 0.599 . . . . 55.340000000000003 111.291 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.409 ' NE2' HE21 ' A' ' 66' ' ' GLN . 78.6 mt-30 -85.02 -29.23 25.14 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.629 0.771 . . . . 75.349999999999994 111.937 -172.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 58.9 m -118.98 87.35 33.73 Favored Pre-proline 0 CA--C 1.544 0.749 0 N-CA-C 107.72 -1.215 . . . . 64.120000000000005 107.72 177.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.07 -17.77 45.78 Favored 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 123.11 2.54 . . . . 75.409999999999997 113.456 -172.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.5 -12.89 83.96 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-O 119.14 -0.811 . . . . 43.409999999999997 114.364 -177.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.4 t -70.64 123.32 24.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-N 117.491 0.646 . . . . 65.420000000000002 110.7 -175.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -81.22 -50.78 9.16 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.693 1.197 . . . . 74.219999999999999 110.168 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 56.7 p -157.62 163.65 38.05 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 114.637 -1.165 . . . . 72.340000000000003 110.911 -173.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.4 mt -119.27 164.94 14.9 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 124.761 1.224 . . . . 71.140000000000001 108.533 177.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.56 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 56.0 ttm -138.33 108.43 6.4 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 107.982 -1.118 . . . . 73.230000000000004 107.982 166.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.75 HD13 HD13 ' A' ' 84' ' ' LEU . 23.0 mm -83.81 102.05 9.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 108.465 -0.939 . . . . 70.239999999999995 108.465 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.38 -173.69 48.43 Favored Glycine 0 C--O 1.241 0.574 0 N-CA-C 110.511 -1.036 . . . . 74.230000000000004 110.511 173.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.74 -63.49 1.05 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.159 -0.682 . . . . 71.439999999999998 109.159 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -95.57 -21.59 18.16 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.025 0.53 . . . . 64.420000000000002 111.563 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -120.13 169.68 10.01 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.738 0.644 . . . . 73.409999999999997 112.738 -168.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.75 HD13 HD13 ' A' ' 79' ' ' ILE . 18.0 tp -142.79 117.64 9.92 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.164 1.386 . . . . 62.130000000000003 107.827 176.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.56 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 58.4 m -96.95 109.69 22.38 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.811 -0.811 . . . . 64.319999999999993 108.811 -177.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 25.8 mm -89.33 124.13 41.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.448 -0.945 . . . . 64.0 108.448 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -109.86 127.95 55.03 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.394 -1.336 . . . . 64.299999999999997 107.394 175.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.505 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -130.8 172.29 12.17 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.79 0.436 . . . . 74.319999999999993 110.093 -176.874 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.407 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 12.5 t70 -81.44 141.94 33.42 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 109.01 -0.737 . . . . 74.150000000000006 109.01 172.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -66.35 -10.88 47.44 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 113.581 0.956 . . . . 72.049999999999997 113.581 -172.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . 0.435 ' HG3' HG23 ' A' ' 92' ' ' VAL . 24.1 ptm -76.04 -28.04 57.52 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.174 0.443 . . . . 54.310000000000002 111.144 175.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.435 HG23 ' HG3' ' A' ' 91' ' ' MET . 40.9 t -99.1 127.29 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 109.051 -0.722 . . . . 74.409999999999997 109.051 -175.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -95.3 154.12 17.35 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.35 0.66 . . . . 73.310000000000002 111.129 -173.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.505 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 97.2 m95 -68.04 -13.78 62.46 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.19 0.996 . . . . 72.409999999999997 112.598 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -52.5 -35.0 52.02 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.115 0.966 . . . . 73.340000000000003 111.876 175.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.4 t -97.26 -32.79 11.73 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.315 0.646 . . . . 74.140000000000001 110.826 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 65.1 mt -80.55 -51.27 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 123.509 0.724 . . . . 55.229999999999997 110.857 -166.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.468 ' HG3' ' HB3' ' A' ' 94' ' ' TRP . 59.8 mtpt -54.85 -58.45 14.46 Favored Pre-proline 0 N--CA 1.484 1.246 0 CA-C-O 117.583 -1.199 . . . . 74.310000000000002 113.064 -174.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -59.73 -36.25 92.24 Favored 'Trans proline' 0 C--N 1.398 3.135 0 C-N-CA 121.804 1.669 . . . . 33.210000000000001 112.203 -171.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.414 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 53.5 mt-10 -64.91 -46.43 81.74 Favored 'General case' 0 C--N 1.35 0.598 0 O-C-N 123.96 0.788 . . . . 64.519999999999996 110.272 177.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.33 -32.18 49.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 123.456 0.703 . . . . 73.5 111.888 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 98' ' ' LYS . 45.0 mm -62.99 -44.0 99.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 N-CA-C 109.165 -0.68 . . . . 72.230000000000004 109.165 175.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.56 -50.94 70.63 Favored 'General case' 0 C--N 1.354 0.783 0 CA-C-N 114.989 -1.005 . . . . 74.340000000000003 110.421 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 96.0 mt -61.85 -39.68 92.7 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.095 0.958 . . . . 71.329999999999998 111.567 -177.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.477 HD12 HD11 ' A' ' 63' ' ' LEU . 7.6 mp -64.73 -37.39 87.45 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.297 0.639 . . . . 74.129999999999995 110.812 176.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 85.4 m -71.8 -34.09 69.08 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.812 0.445 . . . . 73.340000000000003 109.978 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -67.41 -47.49 70.13 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 123.515 0.726 . . . . 75.420000000000002 109.994 176.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -48.24 81.29 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 124.22 0.95 . . . . 73.329999999999998 109.995 -175.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.425 ' HB3' ' HB2' ' A' ' 38' ' ' GLU . 67.3 mt -68.2 -14.24 62.83 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.916 0.76 . . . . 74.340000000000003 112.19 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -89.46 -22.15 22.63 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.542 0.737 . . . . 71.200000000000003 111.379 174.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -90.51 -51.98 5.13 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.229 0.538 . . . . 75.150000000000006 110.554 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -142.5 146.98 18.31 Favored Glycine 0 C--N 1.343 0.954 0 CA-C-N 114.974 -1.012 . . . . 62.350000000000001 111.835 -175.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -77.64 -34.58 53.14 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.591 0.756 . . . . 74.150000000000006 111.026 -174.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -97.7 138.82 34.5 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.002 0.521 . . . . 62.299999999999997 109.667 170.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 3.7 p . . . . . 0 CA--C 1.543 0.693 0 C-N-CA 123.781 0.832 . . . . 74.340000000000003 111.304 -178.39 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.1 mt . . . . . 0 N--CA 1.477 0.903 0 CA-C-O 121.028 0.442 . . . . 73.400000000000006 111.608 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -95.2 145.73 24.83 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.674 0.79 . . . . 73.129999999999995 109.018 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.0 mm -129.03 126.78 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 106.75 -1.574 . . . . 74.450000000000003 106.75 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -105.75 125.73 51.33 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.311 -0.996 . . . . 51.409999999999997 108.311 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.9 t -102.57 113.15 26.27 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 109.101 -0.704 . . . . 61.109999999999999 109.101 -177.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.8 mt -101.3 140.55 35.44 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.579 0.752 . . . . 44.119999999999997 110.321 177.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 28.0 p -85.34 157.69 20.47 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.005 0.522 . . . . 74.439999999999998 111.211 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.3 p -126.72 161.48 52.86 Favored Pre-proline 0 CA--C 1.558 1.283 0 C-N-CA 124.762 1.225 . . . . 65.430000000000007 108.305 -177.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -61.53 -17.92 56.74 Favored 'Trans proline' 0 C--N 1.383 2.364 0 C-N-CA 122.23 1.953 . . . . 62.039999999999999 113.526 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -101.29 132.41 46.83 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 108.684 -0.858 . . . . 61.219999999999999 108.684 175.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.09 -16.6 56.52 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.563 0.345 . . . . 61.140000000000001 111.918 -176.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.407 ' N ' HD22 ' A' ' 28' ' ' ASN . 0.7 OUTLIER -70.6 -38.75 74.04 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 109.41 -0.589 . . . . 72.030000000000001 109.41 175.044 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.48 144.62 26.63 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.499 0.72 . . . . 74.120000000000005 110.67 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.5 tp -154.94 124.29 6.38 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.211 -0.663 . . . . 74.010000000000005 109.211 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -83.63 121.37 27.16 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.766 0.826 . . . . 63.240000000000002 110.837 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -109.4 112.73 25.02 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.299 1.04 . . . . 74.420000000000002 108.468 168.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.2 tp -105.01 134.48 48.04 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.27 1.028 . . . . 55.020000000000003 109.352 -176.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.4 p -74.91 105.25 5.85 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 108.54 -0.911 . . . . 71.140000000000001 108.54 172.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.6 m -107.97 39.97 1.84 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.473 1.109 . . . . 74.209999999999994 110.025 -168.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -137.16 -156.14 0.67 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.043 -0.98 . . . . 63.140000000000001 108.548 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -72.87 -20.62 79.91 Favored Glycine 0 C--N 1.352 1.423 0 CA-C-N 118.295 0.498 . . . . 70.409999999999997 113.352 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -94.76 158.7 15.39 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 121.31 0.576 . . . . 55.299999999999997 111.633 -176.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.5 ttt -134.25 150.97 51.06 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.604 1.162 . . . . 74.150000000000006 109.128 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.546 ' O ' ' HB3' ' A' ' 114' ' ' ASP . 94.1 mt -78.77 -58.07 3.43 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.86 0.689 . . . . 63.119999999999997 112.86 -175.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 . . . . . 0 N--CA 1.48 1.07 0 O-C-N 121.591 -0.693 . . . . 72.340000000000003 109.731 -177.352 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.4 t . . . . . 0 CA--C 1.548 0.876 0 N-CA-C 109.822 -0.436 . . . . 74.120000000000005 109.822 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -93.35 142.59 27.15 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.073 0.949 . . . . 52.340000000000003 108.669 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.4 m -79.36 83.28 5.41 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 108.726 -0.842 . . . . 71.400000000000006 108.726 172.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 52.5 mt -73.93 99.58 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 CA-C-N 115.536 -0.756 . . . . 71.540000000000006 109.956 -170.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 77' ' ' LEU . 40.0 t -96.31 107.61 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 108.907 -0.775 . . . . 72.040000000000006 108.907 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.42 HG23 ' HB2' ' A' ' 57' ' ' LEU . 71.9 mt -105.18 113.46 42.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.436 1.094 . . . . 64.540000000000006 108.401 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.6 mtmp? -80.2 161.53 25.15 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 108.862 -0.792 . . . . 72.409999999999997 108.862 176.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -64.09 -18.38 64.34 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.668 0.787 . . . . 74.310000000000002 111.935 178.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 74.1 p -74.9 -27.77 60.36 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.52 1.128 . . . . 65.400000000000006 112.08 175.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.89 69.35 10.55 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.792 0.837 . . . . 61.140000000000001 111.225 -172.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -60.12 -29.62 68.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.416 0.686 . . . . 74.230000000000004 111.609 -177.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -58.3 -48.46 80.44 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.684 1.194 . . . . 70.439999999999998 110.932 175.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.42 ' HB2' HG23 ' A' ' 50' ' ' ILE . 89.8 mt -79.05 -29.97 43.8 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 115.517 -0.765 . . . . 72.239999999999995 111.227 -177.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 93.5 mt -65.84 -43.48 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.874 0.869 . . . . 71.25 109.859 176.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.432 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 90.2 m-20 -69.96 -7.72 43.02 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.882 0.697 . . . . 62.520000000000003 112.882 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -91.89 -6.12 52.03 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 122.873 0.469 . . . . 73.430000000000007 110.946 174.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 19.3 p -140.2 104.78 4.89 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 123.748 0.819 . . . . 70.450000000000003 109.596 -179.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 38.6 ttpt -56.69 -29.37 62.3 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.898 0.479 . . . . 74.109999999999999 111.461 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.525 HD11 HD12 ' A' ' 105' ' ' LEU . 25.5 tp -59.19 -46.62 87.95 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 123.292 0.637 . . . . 64.510000000000005 110.522 178.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.53 -47.16 86.61 Favored 'General case' 0 C--N 1.348 0.5 0 O-C-N 124.242 0.964 . . . . 73.239999999999995 110.375 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.432 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 97.6 mt-30 -54.4 -46.74 73.2 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.461 1.101 . . . . 75.549999999999997 111.57 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 15.0 mm100 -73.58 -35.26 65.42 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 116.043 -0.526 . . . . 74.299999999999997 112.027 -177.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 65.8 mt -65.45 -46.47 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 122.983 0.513 . . . . 74.420000000000002 110.319 177.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -70.08 -28.7 65.64 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.054 0.542 . . . . 73.040000000000006 111.71 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.5 tp -69.63 -55.99 8.52 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.727 0.411 . . . . 75.150000000000006 110.278 175.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.452 HE22 HD21 ' A' ' 104' ' ' LEU . 78.1 mt-30 -70.6 -26.81 63.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.367 -0.833 . . . . 41.240000000000002 110.949 -175.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.717 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 77.6 m -144.25 91.91 6.29 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 123.334 0.654 . . . . 54.439999999999998 109.932 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.58 3.01 5.18 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 122.97 2.447 . . . . 50.109999999999999 113.691 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -94.26 22.49 36.58 Favored Glycine 0 C--N 1.347 1.16 0 C-N-CA 122.82 0.248 . . . . 60.43 113.244 175.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.428 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 60.5 t -98.75 132.24 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.494 0.718 . . . . 72.530000000000001 109.707 172.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -88.61 -48.17 7.75 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.124 0.969 . . . . 71.230000000000004 112.602 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 53.9 p -159.25 163.24 36.02 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.859 0.464 . . . . 73.319999999999993 111.509 -177.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 49' ' ' VAL . 42.3 mt -124.88 125.59 44.21 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 107.983 -1.117 . . . . 63.119999999999997 107.983 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.499 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.9 ttm -105.47 112.68 25.86 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 107.657 -1.238 . . . . 63.409999999999997 107.657 174.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.509 HD12 HG21 ' A' ' 115' ' ' VAL . 18.9 mm -86.71 113.5 24.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.548 0 N-CA-C 107.956 -1.127 . . . . 74.439999999999998 107.956 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -84.12 -171.45 47.9 Favored Glycine 0 C--O 1.243 0.663 0 N-CA-C 111.373 -0.691 . . . . 65.140000000000001 111.373 174.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -70.12 -60.57 2.21 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.381 -0.599 . . . . 72.439999999999998 109.381 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -96.67 -37.09 10.47 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.587 1.155 . . . . 74.329999999999998 109.989 178.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -102.92 175.87 5.34 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.512 -1.222 . . . . 75.109999999999999 112.529 -165.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.406 HD21 HD11 ' A' ' 86' ' ' ILE . 29.2 tp -129.57 146.6 51.37 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 106.69 -1.596 . . . . 54.009999999999998 106.69 173.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.499 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 89.9 m -130.01 110.1 11.38 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.476 -0.935 . . . . 61.130000000000003 108.476 174.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.549 HG13 HD13 ' A' ' 101' ' ' ILE . 22.5 mm -88.56 118.18 33.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 108.653 -0.869 . . . . 51.299999999999997 108.653 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -96.28 116.92 29.79 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 107.9 -1.148 . . . . 65.109999999999999 107.9 172.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 19.5 pttp -104.58 175.02 5.63 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.527 0.731 . . . . 71.540000000000006 109.354 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -74.74 137.52 42.09 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.154 -0.93 . . . . 75.299999999999997 108.732 168.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -36.38 74.53 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.21 1.404 . . . . 74.310000000000002 113.002 -176.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 66.3 mtt -83.83 -15.17 49.28 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.565 0.746 . . . . 61.329999999999998 111.431 -177.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.9 t -88.33 144.76 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 109.323 -0.621 . . . . 74.219999999999999 109.323 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -105.11 144.56 31.74 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.101 0.961 . . . . 74.140000000000001 110.556 -171.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 53.1 m95 -66.98 -23.79 65.98 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 114.069 1.137 . . . . 73.109999999999999 114.069 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -61.48 -21.34 64.1 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.123 0.569 . . . . 64.540000000000006 112.0 -172.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -92.88 -33.78 14.08 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.393 0.677 . . . . 71.109999999999999 111.71 174.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.717 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 34.6 mt -83.44 -47.29 18.21 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 C-N-CA 123.245 0.618 . . . . 63.420000000000002 111.315 -166.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -53.83 -53.23 60.13 Favored Pre-proline 0 N--CA 1.486 1.355 0 CA-C-O 117.651 -1.166 . . . . 54.299999999999997 114.015 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -56.87 -37.93 97.07 Favored 'Trans proline' 0 C--N 1.399 3.231 0 C-N-CA 122.142 1.895 . . . . 73.150000000000006 111.701 -176.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -61.45 -53.78 52.09 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.033 -0.985 . . . . 40.240000000000002 110.396 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.549 HD13 HG13 ' A' ' 86' ' ' ILE . 65.0 mt -61.42 -51.94 67.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.904 0 O-C-N 124.132 0.895 . . . . 75.209999999999994 111.917 -178.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 98.0 mt -56.45 -43.61 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 123.757 0.823 . . . . 74.219999999999999 111.483 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.25 -48.99 79.57 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.906 0.754 . . . . 51.539999999999999 110.067 177.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.452 HD21 HE22 ' A' ' 70' ' ' GLN . 84.3 mt -58.39 -44.54 88.97 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 114.656 -1.157 . . . . 72.420000000000002 112.087 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.525 HD12 HD11 ' A' ' 63' ' ' LEU . 10.2 mp -65.84 -33.66 76.35 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.571 0.748 . . . . 62.399999999999999 111.755 -178.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 60.9 m -75.84 -34.68 60.08 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.219 0.608 . . . . 61.450000000000003 110.383 -176.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -75.19 -48.55 23.02 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.077 0.551 . . . . 73.439999999999998 110.177 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.517 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 23.6 tt0 -51.18 -59.9 3.69 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 125.586 1.554 . . . . 75.349999999999994 112.483 -176.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.4 mt -63.41 -26.88 68.94 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.761 -1.108 . . . . 73.430000000000007 110.97 -177.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.98 -10.12 59.35 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.917 0.887 . . . . 65.239999999999995 112.268 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -81.46 -15.18 55.81 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 122.61 0.364 . . . . 65.340000000000003 110.764 169.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 113.88 -28.7 8.27 Favored Glycine 0 C--N 1.346 1.119 0 CA-C-N 116.135 -0.484 . . . . 42.229999999999997 112.101 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -90.42 178.67 6.06 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.621 0.769 . . . . 51.420000000000002 112.724 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.546 ' HB3' ' O ' ' A' ' 40' ' ' LEU . 6.2 m-20 -110.23 -170.64 1.68 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.424 -1.262 . . . . 54.329999999999998 111.453 -170.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.509 HG21 HD12 ' A' ' 79' ' ' ILE . 7.2 p . . . . . 0 N--CA 1.48 1.045 0 C-N-CA 124.316 1.047 . . . . 64.120000000000005 112.196 178.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.3 mm . . . . . 0 CA--C 1.546 0.797 0 N-CA-C 109.161 -0.681 . . . . 75.120000000000005 109.161 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 59.2 m80 -74.04 116.01 14.18 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.484 1.114 . . . . 60.32 110.196 -177.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.8 mm -122.98 114.46 42.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.827 0 N-CA-C 107.697 -1.223 . . . . 62.100000000000001 107.697 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 40.7 ttmt -98.94 131.35 45.07 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.473 0.709 . . . . 71.209999999999994 109.992 -177.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.7 m -93.55 114.01 26.26 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.969 -0.752 . . . . 74.450000000000003 108.969 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.3 mt -121.14 137.61 54.59 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.859 0.864 . . . . 72.019999999999996 110.141 -175.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.2 p -85.73 153.83 22.05 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.876 0.87 . . . . 54.409999999999997 111.09 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.418 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 47.7 p -121.51 175.67 2.35 Favored Pre-proline 0 CA--C 1.56 1.35 0 N-CA-C 107.715 -1.217 . . . . 75.209999999999994 107.715 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.418 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 62.6 Cg_endo -71.76 2.76 4.36 Favored 'Trans proline' 0 C--N 1.377 2.057 0 C-N-CA 121.886 1.724 . . . . 72.540000000000006 113.061 167.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.562 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 91.2 m-20 -108.3 135.7 49.17 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.212 1.005 . . . . 75.109999999999999 111.501 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -72.02 -25.37 61.79 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.207 1.003 . . . . 73.430000000000007 111.623 174.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 87' ' ' ASN . 86.7 m-20 -112.02 29.94 7.46 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.021 0.928 . . . . 52.399999999999999 110.553 -176.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.562 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -142.01 124.73 15.95 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.177 0.591 . . . . 40.399999999999999 109.634 172.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.1 tp -135.02 121.43 20.42 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 108.609 -0.885 . . . . 74.519999999999996 108.609 178.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.532 ' HE2' HD13 ' A' ' 33' ' ' LEU . 87.8 tttt -87.61 119.43 27.91 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.181 0.992 . . . . 71.120000000000005 111.116 -175.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -103.8 111.21 23.63 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 107.818 -1.178 . . . . 71.409999999999997 107.818 173.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.532 HD13 ' HE2' ' A' ' 31' ' ' LYS . 37.8 tp -104.35 128.16 52.13 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 124.382 1.073 . . . . 61.210000000000001 110.185 -167.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 28.4 m -70.76 105.69 3.29 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.753 -1.202 . . . . 73.400000000000006 107.753 170.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.0 m -86.87 -15.53 38.78 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.858 0.463 . . . . 52.340000000000003 111.754 -168.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.58 -64.3 1.1 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.531 0.733 . . . . 75.329999999999998 111.201 -178.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.418 ' O ' ' HG3' ' A' ' 39' ' ' MET . . . 156.08 -7.4 0.25 Allowed Glycine 0 C--N 1.341 0.847 0 CA-C-O 119.392 -0.671 . . . . 74.329999999999998 113.302 -174.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 109' ' ' LEU . 1.0 OUTLIER -71.07 104.72 3.11 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 108.158 -1.053 . . . . 73.310000000000002 108.158 168.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.418 ' HG3' ' O ' ' A' ' 37' ' ' GLY . 87.9 mtp -103.3 151.04 23.17 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.652 0.781 . . . . 74.420000000000002 110.605 -170.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.7 mt -71.4 -36.4 71.37 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.885 0.874 . . . . 63.229999999999997 112.008 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 . . . . . 0 N--CA 1.485 1.325 0 C-N-CA 123.515 0.726 . . . . 74.109999999999999 109.644 -179.706 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 41.4 t . . . . . 0 N--CA 1.473 0.716 0 CA-C-O 120.88 0.371 . . . . 72.400000000000006 111.0 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -70.35 158.25 36.28 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 115.16 -0.927 . . . . 71.310000000000002 110.52 173.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.3 m -78.67 89.15 4.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.372 0.669 . . . . 70.219999999999999 109.431 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.635 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 42.8 mt -77.21 100.42 2.71 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 108.852 -0.795 . . . . 71.329999999999998 108.852 -177.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.1 t -90.33 109.8 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.549 0.74 . . . . 64.329999999999998 109.267 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 81.4 mt -118.73 111.06 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.39 1.076 . . . . 63.539999999999999 108.575 -178.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.525 ' HG2' ' HB3' ' A' ' 76' ' ' SER . 94.9 mttt -88.03 159.36 18.3 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 109.666 -0.494 . . . . 74.010000000000005 109.666 176.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -64.83 -20.93 66.66 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.918 0.487 . . . . 73.530000000000001 110.934 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 22.9 p -78.61 -31.23 46.96 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.124 0.97 . . . . 70.200000000000003 110.985 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -76.48 74.31 3.22 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.584 0.754 . . . . 51.299999999999997 110.128 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -55.88 -43.53 77.26 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.926 0.89 . . . . 64.340000000000003 111.742 -175.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -55.59 -48.31 75.05 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.09 0.956 . . . . 74.430000000000007 110.907 -177.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.3 mt -62.39 -36.05 81.09 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.102 -0.954 . . . . 71.140000000000001 111.052 -178.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 54.0 mt -73.51 -45.27 52.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 123.183 0.593 . . . . 52.409999999999997 110.311 -177.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -54.12 -30.87 50.49 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.422 1.089 . . . . 73.5 111.791 -178.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 64.1 m80 -87.81 -44.66 10.95 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.666 0.787 . . . . 71.129999999999995 110.703 175.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 50.5 m -79.04 98.76 6.6 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.056 0.455 . . . . 73.400000000000006 111.376 -176.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.409 ' HE3' HE22 ' A' ' 108' ' ' GLN . 31.6 ttpt -46.55 -53.08 12.07 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.716 1.607 . . . . 73.420000000000002 113.63 178.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.451 ' HB3' HG23 ' A' ' 115' ' ' VAL . 30.5 tp -65.3 -34.85 79.31 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.976 0.51 . . . . 75.349999999999994 111.722 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.15 -40.95 97.7 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 122.329 0.252 . . . . 74.409999999999997 110.527 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -56.07 -50.34 71.27 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.013 0.821 . . . . 75.420000000000002 110.305 176.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -60.83 -48.81 80.09 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.059 0.943 . . . . 74.010000000000005 113.127 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.3 -51.16 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 C-N-CA 123.403 0.681 . . . . 53.119999999999997 111.293 -175.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -67.23 -33.63 75.75 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.046 0.538 . . . . 74.150000000000006 111.193 -179.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.6 tp -59.81 -53.69 54.93 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.499 0.72 . . . . 74.040000000000006 110.794 176.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.504 ' NE2' HD21 ' A' ' 104' ' ' LEU . 74.1 mt-30 -77.45 -24.55 50.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 114.978 -1.01 . . . . 74.319999999999993 112.498 -175.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.564 ' SG ' HG23 ' A' ' 97' ' ' ILE . 72.7 m -144.84 96.91 4.99 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 109.35 -0.611 . . . . 72.109999999999999 109.35 -178.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.4 0.27 10.08 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 122.827 2.352 . . . . 73.120000000000005 113.132 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -84.68 -0.54 89.22 Favored Glycine 0 C--N 1.353 1.503 0 CA-C-O 119.89 -0.394 . . . . 74.230000000000004 113.023 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.0 t -82.22 123.76 38.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.237 0.615 . . . . 52.539999999999999 109.599 176.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -77.79 -55.0 5.69 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.932 0.893 . . . . 75.409999999999997 110.601 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.525 ' HB3' ' HG2' ' A' ' 51' ' ' LYS . 27.7 p -150.14 164.03 36.67 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.577 0.703 . . . . 74.409999999999997 111.459 -175.003 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 78.6 mt -122.57 128.66 51.02 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.427 1.091 . . . . 73.420000000000002 108.265 178.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.538 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.4 ttm -102.25 99.12 9.19 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 106.741 -1.577 . . . . 75.409999999999997 106.741 169.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.635 ' HB ' ' HB ' ' A' ' 48' ' ' ILE . 29.1 mm -80.87 125.22 39.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.24 -1.022 . . . . 72.299999999999997 108.24 -177.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.52 -173.18 20.8 Favored Glycine 0 C--O 1.242 0.6 0 N-CA-C 111.539 -0.625 . . . . 73.310000000000002 111.539 172.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -80.06 -58.18 3.28 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 122.807 0.443 . . . . 71.239999999999995 110.453 176.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -113.79 18.51 17.35 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 122.877 0.471 . . . . 71.409999999999997 110.92 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -148.5 163.61 36.66 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 122.755 0.422 . . . . 73.140000000000001 110.944 -177.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 51.8 tp -144.94 107.05 4.32 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.472 0.709 . . . . 74.219999999999999 109.243 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.538 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 28.0 m -96.95 106.74 19.13 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.299 -1.0 . . . . 75.129999999999995 108.299 -179.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.653 HG13 HD13 ' A' ' 101' ' ' ILE . 21.8 mm -87.47 141.53 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.518 0.727 . . . . 51.140000000000001 109.291 -175.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.455 ' HA ' ' O ' ' A' ' 28' ' ' ASN . 24.2 m-80 -120.82 120.63 36.13 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.802 0.841 . . . . 74.510000000000005 109.06 176.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.409 ' HD3' ' HB ' ' A' ' 92' ' ' VAL . 0.1 OUTLIER -122.01 165.94 15.25 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.719 0.808 . . . . 70.540000000000006 110.191 179.353 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -68.0 141.45 56.24 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.696 0.798 . . . . 62.299999999999997 109.382 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . 0.444 ' HB3' HD21 ' A' ' 28' ' ' ASN . 2.2 ptm180 -68.63 -10.98 59.43 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 112.855 0.687 . . . . 73.530000000000001 112.855 -171.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.3 ptp -77.95 -16.13 58.42 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.011 0.525 . . . . 71.349999999999994 111.133 174.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.542 HG11 HD11 ' A' ' 97' ' ' ILE . 34.4 t -93.54 141.98 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.148 0.979 . . . . 75.25 110.262 -176.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . 0.528 ' HD2' ' H ' ' A' ' 95' ' ' ASN . 4.8 t60 -95.17 136.23 35.77 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.922 0.889 . . . . 65.25 108.881 176.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 44.9 m95 -58.66 -43.55 89.89 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.611 0.967 . . . . 74.510000000000005 113.611 -174.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . 0.528 ' H ' ' HD2' ' A' ' 93' ' ' HIS . 9.8 t30 -57.82 -18.58 22.96 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.469 0.707 . . . . 63.140000000000001 112.717 -174.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.4 m -69.21 -54.27 15.63 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 121.386 0.613 . . . . 73.099999999999994 110.628 174.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.564 HG23 ' SG ' ' A' ' 71' ' ' CYS . 16.4 mt -83.96 -32.97 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 123.913 0.885 . . . . 75.299999999999997 110.858 -171.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -50.35 -56.08 20.95 Favored Pre-proline 0 CA--C 1.567 1.611 0 C-N-CA 125.038 1.335 . . . . 72.409999999999997 114.219 -172.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.58 -27.59 38.82 Favored 'Trans proline' 0 C--N 1.393 2.869 0 C-N-CA 121.8 1.666 . . . . 53.229999999999997 111.961 -176.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -67.78 -43.38 79.92 Favored 'General case' 0 C--N 1.349 0.568 0 C-N-CA 123.517 0.727 . . . . 71.329999999999998 109.746 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.653 HD13 HG13 ' A' ' 86' ' ' ILE . 95.6 mt -60.01 -51.16 76.15 Favored 'Isoleucine or valine' 0 C--N 1.359 0.998 0 C-N-CA 123.865 0.866 . . . . 71.019999999999996 109.784 176.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 74.0 mt -56.47 -41.04 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.522 0.729 . . . . 74.329999999999998 110.797 -178.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.75 -46.8 77.47 Favored 'General case' 0 CA--C 1.549 0.939 0 O-C-N 123.694 0.621 . . . . 55.109999999999999 110.933 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.504 HD21 ' NE2' ' A' ' 70' ' ' GLN . 99.0 mt -63.97 -35.07 79.48 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.958 0.903 . . . . 71.420000000000002 111.852 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 101' ' ' ILE . 8.6 mp -72.93 -23.72 60.72 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.83 0.852 . . . . 61.240000000000002 110.793 177.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 64.3 m -77.41 -36.59 53.17 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 109.183 -0.673 . . . . 75.019999999999996 109.183 174.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -66.42 -39.29 88.88 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.341 0.656 . . . . 73.010000000000005 110.296 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.409 HE22 ' HE3' ' A' ' 62' ' ' LYS . 11.7 mm100 -60.19 -63.68 1.22 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.561 0.745 . . . . 73.450000000000003 110.714 176.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 38' ' ' GLU . 74.2 mt -78.55 -2.83 40.7 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 114.854 -1.066 . . . . 74.230000000000004 112.377 -167.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -89.71 -49.03 6.88 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.531 0.732 . . . . 73.349999999999994 111.266 171.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -88.88 -52.35 5.15 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 116.129 -0.487 . . . . 72.140000000000001 110.78 -171.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -158.67 103.57 0.23 Allowed Glycine 0 C--N 1.342 0.884 0 N-CA-C 109.867 -1.293 . . . . 61.329999999999998 109.867 -175.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.99 -24.95 64.87 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.908 1.283 . . . . 72.510000000000005 112.778 -164.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -68.05 118.28 11.01 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 123.688 0.618 . . . . 73.340000000000003 109.96 -176.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.527 HG11 HG21 ' A' ' 79' ' ' ILE . 3.5 p . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 125.625 1.57 . . . . 75.409999999999997 112.74 179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.421 ' HB ' HG23 ' A' ' 106' ' ' THR . 77.0 mt . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 108.067 -1.086 . . . . 65.409999999999997 108.067 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.469 ' HB3' ' HB3' ' A' ' 36' ' ' ASP . 62.7 t60 -69.23 122.14 18.23 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 113.829 -1.532 . . . . 72.349999999999994 111.707 -170.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 47.9 mm -126.34 125.55 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 107.239 -1.393 . . . . 70.109999999999999 107.239 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.416 ' HE2' HD23 ' A' ' 33' ' ' LEU . 38.8 ttpt -99.13 126.13 44.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.069 0.548 . . . . 65.400000000000006 109.541 -178.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 35.0 m -92.0 117.21 29.6 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.276 0.63 . . . . 73.430000000000007 109.382 -177.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.6 mt -115.11 138.47 50.86 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.179 0.991 . . . . 52.450000000000003 109.407 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 54.9 p -85.13 153.27 22.79 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.297 0.639 . . . . 71.310000000000002 110.568 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.402 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 71.7 p -119.52 172.73 4.14 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 124.291 1.037 . . . . 75.340000000000003 109.064 -174.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.402 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 86.4 Cg_endo -75.17 14.86 0.83 Allowed 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 122.185 1.923 . . . . 73.549999999999997 113.215 167.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.422 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 11.1 m120 -118.95 157.16 28.26 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 124.167 0.987 . . . . 51.140000000000001 109.361 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.76 -32.93 10.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.276 0.631 . . . . 62.130000000000003 109.931 175.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -71.6 -40.63 69.71 Favored 'General case' 0 C--O 1.215 -0.759 0 C-N-CA 123.0 0.52 . . . . 73.5 110.153 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.422 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -93.09 141.22 28.66 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.075 0.55 . . . . 62.350000000000001 111.487 -175.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.8 tp -140.49 133.2 28.9 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 108.455 -0.943 . . . . 65.299999999999997 108.455 172.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -93.25 131.52 38.29 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.824 0.85 . . . . 65.409999999999997 110.672 -173.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -120.17 121.02 37.84 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.826 1.25 . . . . 75.109999999999999 107.996 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.416 HD23 ' HE2' ' A' ' 20' ' ' LYS . 47.3 tp -106.77 128.8 54.54 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.567 0.747 . . . . 71.420000000000002 110.488 -171.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.2 m -73.91 106.09 5.46 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.319 -0.993 . . . . 64.219999999999999 108.319 171.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.4 m -105.85 -32.19 8.48 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.024 0.53 . . . . 63.240000000000002 111.797 -163.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.469 ' HB3' ' HB3' ' A' ' 18' ' ' HIS . 5.8 p-10 -82.55 -162.55 0.59 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.273 0.229 . . . . 53.109999999999999 110.593 178.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.69 -16.67 63.8 Favored Glycine 0 C--N 1.355 1.589 0 N-CA-C 114.323 0.489 . . . . 51.240000000000002 114.323 -177.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -86.21 147.31 26.17 Favored 'General case' 0 C--N 1.352 0.688 0 CA-C-N 117.82 0.81 . . . . 54.229999999999997 110.266 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 25.4 ttt -147.05 130.64 16.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 107.638 -1.245 . . . . 70.120000000000005 107.638 -173.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.424 ' O ' ' HA ' ' A' ' 114' ' ' ASP . 64.1 mt -54.15 -45.94 72.14 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.87 0.868 . . . . 23.23 112.176 -171.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.558 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 5.4 tt0 . . . . . 0 CA--C 1.544 0.72 0 C-N-CA 125.117 1.367 . . . . 65.329999999999998 108.757 -179.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 29.2 t . . . . . 0 N--CA 1.476 0.874 0 CA-C-O 120.991 0.424 . . . . 70.040000000000006 110.839 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -97.36 -174.37 2.91 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.845 1.258 . . . . 74.340000000000003 110.925 -174.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . 0.4 ' HA ' ' O ' ' A' ' 79' ' ' ILE . 28.0 p -76.82 88.02 3.42 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.235 0.614 . . . . 73.140000000000001 110.1 175.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.7 mt -76.8 127.61 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.803 0.841 . . . . 74.239999999999995 110.828 -177.189 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 95.6 t -89.79 123.81 42.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 N-CA-C 109.127 -0.694 . . . . 62.130000000000003 109.127 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.433 HG12 ' HB3' ' A' ' 57' ' ' LEU . 54.5 mt -116.02 110.11 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 108.283 -1.006 . . . . 62.039999999999999 108.283 174.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -90.87 164.79 13.92 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 109.203 -0.666 . . . . 74.120000000000005 109.203 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -57.44 -27.35 62.36 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 124.168 0.918 . . . . 74.040000000000006 112.292 175.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.5 p -75.31 -33.76 61.2 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.64 0.776 . . . . 73.510000000000005 111.86 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.414 ' O ' HG13 ' A' ' 58' ' ' ILE . 3.9 m-20 -78.86 74.23 5.39 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.431 0.692 . . . . 53.350000000000001 111.164 -170.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -50.49 -42.38 54.6 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.977 1.311 . . . . 73.040000000000006 111.565 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -58.37 -49.25 77.91 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.752 0.821 . . . . 74.340000000000003 111.476 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.433 ' HB3' HG12 ' A' ' 50' ' ' ILE . 80.4 mt -70.49 -38.82 74.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.538 0.735 . . . . 63.43 111.362 -175.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 54' ' ' ASP . 81.4 mt -57.76 -48.13 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.02 0.928 . . . . 75.439999999999998 109.443 175.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -66.64 -26.05 66.88 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.355 0.872 . . . . 62.310000000000002 113.355 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -70.52 -36.57 73.83 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.536 0.334 . . . . 73.239999999999995 111.383 178.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.5 p -116.62 105.72 12.75 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.518 0.727 . . . . 72.420000000000002 109.552 -179.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -62.77 -19.94 64.48 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.993 0.517 . . . . 71.329999999999998 111.427 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.575 HD11 HD12 ' A' ' 105' ' ' LEU . 48.7 tp -60.04 -46.98 87.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.366 0.666 . . . . 71.519999999999996 110.1 170.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.13 -41.81 99.38 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.242 0.617 . . . . 64.230000000000004 110.745 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -56.4 -48.6 76.59 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 123.861 0.726 . . . . 74.319999999999993 110.883 175.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -60.51 -44.56 95.88 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.86 0.864 . . . . 63.32 112.79 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.517 HG22 HG21 ' A' ' 74' ' ' VAL . 97.1 mt -66.54 -46.41 86.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 123.35 0.66 . . . . 75.099999999999994 110.605 -177.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -68.95 -37.07 78.63 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.799 0.44 . . . . 75.340000000000003 111.779 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.2 tp -66.82 -53.83 28.73 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.526 0.73 . . . . 73.299999999999997 110.604 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -81.0 -24.05 38.25 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 114.941 -1.027 . . . . 70.140000000000001 111.666 -173.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 38.2 m -126.37 97.15 34.72 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 109.487 -0.56 . . . . 75.030000000000001 109.487 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.11 -17.34 45.59 Favored 'Trans proline' 0 C--N 1.378 2.093 0 C-N-CA 123.59 2.86 . . . . 64.25 113.879 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -89.96 13.59 64.21 Favored Glycine 0 C--N 1.346 1.11 0 CA-C-O 119.69 -0.505 . . . . 53.240000000000002 113.576 -177.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.517 HG21 HG22 ' A' ' 67' ' ' ILE . 41.6 t -85.69 122.4 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.732 -0.84 . . . . 72.019999999999996 108.732 173.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -90.06 -40.49 12.26 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.509 0.724 . . . . 74.030000000000001 110.085 -177.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.9 p -160.1 170.85 20.38 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.486 -0.779 . . . . 51.030000000000001 110.832 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 85.4 mt -131.61 150.52 52.12 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.045 1.338 . . . . 72.040000000000006 108.516 177.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.414 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 57.6 ttm -123.85 102.56 7.86 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 107.255 -1.387 . . . . 75.219999999999999 107.255 167.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 47' ' ' SER . 15.3 mm -82.5 120.45 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 115.552 -0.749 . . . . 73.540000000000006 109.176 -177.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.06 -179.7 21.28 Favored Glycine 0 C--O 1.242 0.642 0 N-CA-C 111.41 -0.676 . . . . 64.340000000000003 111.41 172.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.558 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 4.5 p-10 -72.33 -53.8 11.32 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.294 0.638 . . . . 53.140000000000001 110.774 178.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 0.4 ' O ' HD12 ' A' ' 33' ' ' LEU . 14.0 p-10 -116.58 -0.3 12.47 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.755 -0.591 . . . . 72.420000000000002 111.435 177.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -126.52 156.24 41.09 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.754 -0.462 . . . . 72.310000000000002 109.754 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.549 HD23 HD11 ' A' ' 105' ' ' LEU . 39.5 tp -144.84 119.69 9.92 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.216 -0.661 . . . . 72.099999999999994 109.216 176.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 32.9 m -107.59 108.35 19.59 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 109.415 -0.587 . . . . 75.299999999999997 109.415 -177.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.511 ' HB ' ' HH2' ' A' ' 94' ' ' TRP . 21.1 mm -89.66 141.48 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 N-CA-C 108.259 -1.015 . . . . 74.340000000000003 108.259 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -114.31 119.67 37.76 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.601 -0.518 . . . . 75.010000000000005 109.601 179.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.676 ' HZ2' HD13 ' A' ' 97' ' ' ILE . 5.0 mptp? -105.45 159.31 16.03 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.684 1.194 . . . . 64.299999999999997 110.734 177.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.4 ' HB3' HG23 ' A' ' 92' ' ' VAL . 13.5 t70 -69.49 145.46 52.69 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 114.187 -1.369 . . . . 73.409999999999997 109.254 172.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -25.69 68.42 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 123.886 0.874 . . . . 75.200000000000003 113.093 -176.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 65.6 mtm -87.58 -9.01 55.55 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.672 0.789 . . . . 74.540000000000006 111.276 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.4 HG23 ' HB3' ' A' ' 89' ' ' ASP . 39.8 t -102.53 135.98 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 109.528 -0.545 . . . . 71.439999999999998 109.528 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -79.64 138.17 37.32 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.233 1.013 . . . . 61.009999999999998 111.387 -172.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.511 ' HH2' ' HB ' ' A' ' 86' ' ' ILE . 6.0 m95 -80.38 -52.8 7.25 Favored 'General case' 0 N--CA 1.483 1.217 0 N-CA-C 113.277 0.844 . . . . 73.219999999999999 113.277 -174.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.87 -18.16 54.52 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.782 0.833 . . . . 63.409999999999997 112.843 -174.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.1 t -74.67 -40.77 61.21 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.168 0.987 . . . . 64.519999999999996 110.267 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.676 HD13 ' HZ2' ' A' ' 88' ' ' LYS . 16.2 mt -94.12 -15.54 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 CA-C-N 115.162 -0.926 . . . . 73.409999999999997 112.552 -168.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -49.63 -47.89 77.64 Favored Pre-proline 0 N--CA 1.491 1.579 0 CA-C-O 118.193 -0.908 . . . . 71.329999999999998 113.114 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -56.36 -39.12 93.39 Favored 'Trans proline' 0 C--N 1.396 3.073 0 C-N-CA 122.012 1.808 . . . . 60.030000000000001 113.126 176.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.461 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 8.3 mm-40 -63.61 -50.95 67.36 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.344 0.658 . . . . 74.109999999999999 110.403 -178.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.44 ' O ' HD13 ' A' ' 105' ' ' LEU . 76.4 mt -61.17 -54.84 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.017 -0.992 . . . . 74.239999999999995 110.489 -177.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 89.1 mt -55.37 -38.28 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 123.511 0.724 . . . . 74.230000000000004 110.96 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -66.17 -43.69 86.19 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.493 0.717 . . . . 73.540000000000006 111.112 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 88.9 mt -64.35 -38.57 91.52 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.463 0.705 . . . . 74.230000000000004 111.194 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.575 HD12 HD11 ' A' ' 63' ' ' LEU . 10.0 mp -63.52 -34.45 77.81 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.645 0.778 . . . . 75.230000000000004 110.277 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.421 HG23 ' HB ' ' A' ' 17' ' ' ILE . 93.1 m -72.96 -31.32 64.48 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.302 0.641 . . . . 74.0 110.102 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -63.86 -54.42 35.22 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.9 0.48 . . . . 61.219999999999999 110.35 176.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -58.27 -45.05 88.58 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 123.824 0.703 . . . . 73.439999999999998 111.541 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.402 HD21 ' HA ' ' A' ' 40' ' ' LEU . 95.8 mt -75.93 -17.83 59.6 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.091 -0.959 . . . . 50.229999999999997 111.434 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.34 -28.8 59.75 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.143 0.577 . . . . 63.219999999999999 110.418 172.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -72.31 -27.09 62.23 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.148 -0.478 . . . . 65.120000000000005 109.921 168.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.67 30.38 64.12 Favored Glycine 0 C--N 1.353 1.516 0 CA-C-N 115.513 -0.767 . . . . 65.329999999999998 111.213 -172.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -92.91 139.96 29.98 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.441 1.096 . . . . 74.340000000000003 111.151 -171.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.424 ' HA ' ' O ' ' A' ' 40' ' ' LEU . 5.8 m-20 -76.65 119.11 20.01 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.474 -0.936 . . . . 74.519999999999996 108.474 169.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 2.7 p . . . . . 0 CA--C 1.553 1.074 0 C-N-CA 125.636 1.574 . . . . 53.530000000000001 112.385 -176.22 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.8 mt . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 109.808 -0.441 . . . . 73.109999999999999 109.808 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -72.31 122.24 20.81 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.421 -0.809 . . . . 73.329999999999998 109.564 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.8 mm -115.55 122.22 68.91 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 105.599 -2.0 . . . . 51.539999999999999 105.599 177.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -91.01 120.59 32.13 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.308 -0.997 . . . . 74.25 108.308 -172.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.7 m -93.25 113.29 25.46 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.522 -0.918 . . . . 63.520000000000003 108.522 -176.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.9 mt -105.83 138.14 42.53 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.601 0.76 . . . . 44.530000000000001 109.388 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.0 p -73.71 142.63 46.34 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.708 0.803 . . . . 71.420000000000002 110.695 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 p -113.09 168.0 8.4 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 124.681 1.192 . . . . 71.030000000000001 109.827 -174.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -67.73 -10.87 30.21 Favored 'Trans proline' 0 C--N 1.383 2.388 0 C-N-CA 122.693 2.262 . . . . 71.420000000000002 113.459 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -125.12 134.52 52.42 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.456 0.702 . . . . 71.439999999999998 109.761 -178.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -73.2 -24.85 60.57 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.279 0.632 . . . . 53.119999999999997 110.973 173.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -66.08 -20.75 66.26 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.115 0.966 . . . . 60.210000000000001 111.218 176.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.1 162.56 22.22 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.24 1.016 . . . . 74.409999999999997 110.107 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.4 tp -160.66 131.24 5.36 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 109.571 -0.529 . . . . 71.140000000000001 109.571 173.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -85.44 117.11 24.16 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.281 1.032 . . . . 72.530000000000001 110.85 -174.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -107.77 110.8 22.7 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.399 1.079 . . . . 73.439999999999998 108.216 173.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.6 tp -102.84 123.61 46.81 Favored 'General case' 0 C--O 1.243 0.744 0 N-CA-C 108.674 -0.861 . . . . 55.130000000000003 108.674 -169.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.1 p -80.87 106.21 12.7 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 107.828 -1.175 . . . . 71.439999999999998 107.828 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.2 p -109.89 -58.52 2.05 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.765 0.826 . . . . 74.430000000000007 110.181 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -69.72 110.29 4.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.135 0.974 . . . . 63.130000000000003 111.607 -172.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.08 -85.23 1.01 Allowed Glycine 0 C--N 1.342 0.911 0 O-C-N 124.107 0.879 . . . . 63.100000000000001 112.989 174.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.8 mp0 -95.62 164.14 12.9 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.9 0.88 . . . . 62.439999999999998 111.993 -170.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.3 ttt -125.58 147.28 49.34 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.077 1.751 . . . . 63.200000000000003 107.554 -177.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.7 mt -67.35 -51.97 45.84 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.085 0.772 . . . . 61.329999999999998 113.085 -169.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.62 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.1 tt0 . . . . . 0 N--CA 1.478 0.938 0 C-N-CA 123.239 0.616 . . . . 70.099999999999994 109.55 -172.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.5 p . . . . . 0 CA--C 1.541 0.605 0 N-CA-C 110.04 -0.356 . . . . 73.409999999999997 110.04 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -98.26 162.49 13.16 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.635 0.774 . . . . 75.140000000000001 110.067 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 p -82.82 99.5 9.74 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.615 0.766 . . . . 70.340000000000003 109.774 176.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.0 mt -76.87 107.73 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 123.142 0.577 . . . . 73.400000000000006 110.377 -173.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 76.8 t -87.55 105.34 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 108.046 -1.094 . . . . 74.239999999999995 108.046 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 75.2 mt -94.83 109.09 21.73 Favored 'Isoleucine or valine' 0 C--N 1.337 0.062 0 N-CA-C 107.999 -1.112 . . . . 75.129999999999995 107.999 -178.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -87.64 142.22 28.01 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.679 0.792 . . . . 72.420000000000002 109.77 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.505 ' HA ' HD11 ' A' ' 58' ' ' ILE . 36.9 p30 -67.43 -22.45 65.51 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.245 0.618 . . . . 74.349999999999994 111.574 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.2 t -87.85 -4.79 58.83 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.95 0.9 . . . . 71.420000000000002 112.043 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -108.11 103.7 12.97 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.102 0.561 . . . . 62.340000000000003 110.186 -175.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -45.44 -61.97 1.46 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 124.932 1.293 . . . . 55.299999999999997 113.605 176.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -69.65 -30.95 68.76 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.758 0.651 . . . . 53.310000000000002 112.758 -166.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.17 -36.17 83.18 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 123.397 0.436 . . . . 73.319999999999993 111.666 175.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.505 HD11 ' HA ' ' A' ' 52' ' ' ASN . 39.6 mt -84.22 -38.17 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 123.309 0.644 . . . . 62.130000000000003 110.381 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -56.19 -39.85 73.06 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 125.061 1.344 . . . . 64.400000000000006 112.15 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -85.98 -1.98 57.85 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.798 -0.637 . . . . 71.409999999999997 111.566 -176.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.0 p -127.78 101.38 6.33 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.208 0.603 . . . . 73.219999999999999 111.135 -172.828 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -57.65 -47.28 82.72 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.473 1.109 . . . . 74.319999999999993 112.287 -177.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.403 HD11 HD12 ' A' ' 105' ' ' LEU . 49.5 tp -63.93 -35.99 82.47 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 123.912 0.758 . . . . 74.310000000000002 111.409 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.39 -40.94 89.96 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.668 0.387 . . . . 72.109999999999999 111.189 178.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.419 ' HG2' HG22 ' A' ' 58' ' ' ILE . 96.6 mt-30 -58.79 -43.5 90.5 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 124.241 0.963 . . . . 72.549999999999997 110.242 176.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -58.66 -51.45 69.88 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.644 0.778 . . . . 75.140000000000001 112.519 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 83.3 mt -66.18 -44.54 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.434 0.694 . . . . 62.509999999999998 111.35 -173.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -71.13 -37.69 72.3 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 112.243 0.46 . . . . 72.0 112.243 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 42.9 tp -69.87 -45.92 66.65 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.865 0.466 . . . . 71.340000000000003 110.919 -177.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -81.08 -29.88 34.84 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.222 0.609 . . . . 74.530000000000001 111.691 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 63.9 m -133.28 88.11 36.5 Favored Pre-proline 0 CA--C 1.548 0.904 0 N-CA-C 109.057 -0.72 . . . . 73.420000000000002 109.057 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -77.02 -2.32 12.56 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 122.735 2.29 . . . . 72.099999999999994 112.758 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.04 3.4 71.13 Favored Glycine 0 C--N 1.356 1.659 0 CA-C-N 116.327 -0.397 . . . . 71.430000000000007 113.18 176.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.0 t -92.68 133.3 34.42 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.405 1.082 . . . . 74.409999999999997 109.974 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.458 ' H ' ' HA ' ' A' ' 88' ' ' LYS . 16.2 mm-40 -86.16 -49.95 7.36 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.381 1.072 . . . . 72.340000000000003 110.703 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.6 p -159.21 163.46 35.91 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.488 -0.778 . . . . 71.409999999999997 111.066 -175.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.4 mt -121.86 125.98 47.68 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 108.535 -0.913 . . . . 54.25 108.535 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.6 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.1 ttm -98.64 99.82 10.98 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 106.897 -1.519 . . . . 61.399999999999999 106.897 174.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.636 HD13 HD13 ' A' ' 84' ' ' LEU . 19.1 mm -85.41 110.67 19.78 Favored 'Isoleucine or valine' 0 C--O 1.242 0.662 0 N-CA-C 108.765 -0.828 . . . . 75.420000000000002 108.765 -172.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -101.25 173.68 24.38 Favored Glycine 0 C--O 1.247 0.931 0 N-CA-C 109.802 -1.319 . . . . 63.119999999999997 109.802 173.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.62 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 10.5 p-10 -74.93 -44.66 47.32 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 122.87 0.468 . . . . 64.329999999999998 110.022 175.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -86.81 -41.72 13.85 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.448 0.699 . . . . 70.230000000000004 111.468 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 36.4 p90 -131.2 171.62 13.08 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 121.247 0.546 . . . . 72.400000000000006 112.204 -164.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.636 HD13 HD13 ' A' ' 79' ' ' ILE . 14.1 tp -139.51 110.8 6.99 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.731 1.212 . . . . 63.530000000000001 107.915 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.6 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 66.7 m -95.42 108.18 20.37 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.088 -1.079 . . . . 70.549999999999997 108.088 -177.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.613 HG13 HD13 ' A' ' 101' ' ' ILE . 12.0 mm -87.01 102.9 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.501 0.72 . . . . 74.340000000000003 109.152 -173.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -84.2 128.08 34.34 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 107.33 -1.359 . . . . 72.329999999999998 107.33 175.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.458 ' HA ' ' H ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -148.93 168.1 23.98 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.603 0.761 . . . . 73.209999999999994 111.867 -171.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -71.42 122.79 21.01 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.197 1.399 . . . . 71.310000000000002 109.799 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -71.45 -12.5 61.43 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 113.147 0.795 . . . . 72.120000000000005 113.147 -170.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.7 mmm -78.06 -30.94 50.02 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.754 -0.461 . . . . 75.299999999999997 109.754 175.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.6 t -83.34 144.94 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 107.923 -1.14 . . . . 75.329999999999998 107.923 175.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -102.14 158.65 16.01 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.3 0.64 . . . . 72.400000000000006 111.636 -171.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -75.68 -24.73 56.31 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.977 0.911 . . . . 72.219999999999999 112.143 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -59.86 -27.32 66.58 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.423 0.689 . . . . 64.439999999999998 111.223 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.2 m -92.79 -35.55 13.35 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.954 0.902 . . . . 62.240000000000002 112.412 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.433 HG22 HD11 ' A' ' 101' ' ' ILE . 24.5 mt -93.28 -45.66 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 CA-C-N 117.861 0.301 . . . . 52.140000000000001 111.212 -170.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -53.5 -46.29 98.19 Favored Pre-proline 0 N--CA 1.492 1.674 0 N-CA-C 114.522 1.304 . . . . 72.400000000000006 114.522 -174.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -55.41 -39.59 90.2 Favored 'Trans proline' 0 C--N 1.392 2.866 0 C-N-CA 121.803 1.668 . . . . 62.119999999999997 112.168 175.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -68.22 -40.45 82.08 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.466 -0.788 . . . . 75.530000000000001 110.382 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.613 HD13 HG13 ' A' ' 86' ' ' ILE . 84.8 mt -62.48 -52.01 65.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.551 0.74 . . . . 72.120000000000005 110.364 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 79.4 mt -61.32 -37.54 77.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.369 0.668 . . . . 63.299999999999997 110.83 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.25 -47.69 72.92 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.431 0.692 . . . . 53.32 111.057 178.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 98.4 mt -68.44 -35.26 77.35 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.761 0.825 . . . . 62.530000000000001 111.99 -179.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.403 HD12 HD11 ' A' ' 63' ' ' LEU . 9.0 mp -69.34 -23.79 63.82 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.315 0.646 . . . . 71.299999999999997 110.492 175.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 53.8 m -78.9 -44.96 21.58 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.265 0.626 . . . . 72.230000000000004 109.993 173.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -57.46 -49.58 75.82 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.017 0.927 . . . . 64.310000000000002 110.483 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -50.57 -60.74 2.71 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.556 1.142 . . . . 74.519999999999996 111.366 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.4 mt -75.43 -19.11 59.68 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 115.682 -0.69 . . . . 74.540000000000006 112.058 -170.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.53 -46.72 14.07 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.599 0.76 . . . . 74.450000000000003 110.769 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -80.15 -15.02 57.99 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 115.92 -0.582 . . . . 64.340000000000003 111.208 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 84.45 19.27 60.63 Favored Glycine 0 C--N 1.35 1.316 0 CA-C-N 116.405 -0.361 . . . . 74.0 112.796 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.15 167.75 17.12 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.442 1.097 . . . . 71.349999999999994 111.148 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.36 139.4 34.18 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.323 1.049 . . . . 64.450000000000003 110.172 -174.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 4.1 p . . . . . 0 N--CA 1.476 0.84 0 N-CA-C 108.868 -0.79 . . . . 70.109999999999999 108.868 165.857 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.0 mt . . . . . 0 N--CA 1.472 0.653 0 N-CA-C 109.136 -0.69 . . . . 75.319999999999993 109.136 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -64.15 118.54 8.72 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.848 1.259 . . . . 74.129999999999995 110.389 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 42.1 mm -122.37 113.42 38.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 N-CA-C 106.193 -1.78 . . . . 75.219999999999999 106.193 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -105.57 119.96 40.44 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 106.891 -1.522 . . . . 65.430000000000007 106.891 -175.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.503 HG21 ' HD2' ' A' ' 98' ' ' LYS . 12.3 t -109.58 111.81 23.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-O 121.834 0.826 . . . . 72.120000000000005 108.934 -171.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.0 mt -91.56 147.6 22.89 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.152 -0.931 . . . . 73.299999999999997 111.342 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.9 p -81.66 145.86 30.34 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.669 -1.15 . . . . 74.25 110.011 176.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 50.1 p -115.81 176.65 1.44 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 107.939 -1.134 . . . . 73.319999999999993 107.939 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -49.8 -30.35 22.89 Favored 'Trans proline' 0 C--N 1.384 2.41 0 C-N-CA 122.079 1.852 . . . . 45.32 113.4 165.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -86.19 146.26 26.63 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 109.083 -0.71 . . . . 73.030000000000001 109.083 174.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -88.76 -36.22 16.24 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.946 0.898 . . . . 71.230000000000004 110.838 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -91.49 -17.39 25.78 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.461 1.104 . . . . 53.420000000000002 111.982 -171.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -99.77 109.34 21.77 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.219 -1.03 . . . . 75.450000000000003 108.219 169.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.2 tp -114.96 126.77 55.16 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.696 -0.853 . . . . 52.399999999999999 108.696 -175.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -92.47 110.08 21.48 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.088 0.955 . . . . 75.340000000000003 110.294 -170.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -92.56 127.19 37.96 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.599 0.76 . . . . 74.230000000000004 109.642 -177.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.3 tp -117.65 137.94 52.31 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.565 0.746 . . . . 73.200000000000003 109.835 -179.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.0 t -89.99 121.27 31.93 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.314 -0.995 . . . . 65.120000000000005 108.314 170.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 34.3 p -99.6 0.62 42.53 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.455 0.539 . . . . 72.239999999999995 112.455 -176.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -103.53 33.11 3.49 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.022 0.529 . . . . 73.349999999999994 111.721 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.68 -44.99 3.29 Favored Glycine 0 C--N 1.347 1.151 0 CA-C-O 119.755 -0.47 . . . . 73.439999999999998 113.97 171.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.518 ' HB3' HD22 ' A' ' 109' ' ' LEU . 9.3 mm-40 -59.29 92.06 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.68 0.792 . . . . 64.340000000000003 112.764 -177.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 51.4 ttm -78.94 138.54 38.13 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 114.822 -1.081 . . . . 53.43 109.104 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.3 mt -63.86 -56.14 17.59 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.772 0.829 . . . . 62.450000000000003 111.279 -172.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 107.895 -1.15 . . . . 65.25 107.895 173.096 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.0 t . . . . . 0 CA--C 1.547 0.847 0 CA-C-O 121.255 0.55 . . . . 60.009999999999998 111.27 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -112.79 158.13 20.49 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.585 1.154 . . . . 74.200000000000003 108.383 177.186 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.5 m -76.58 93.29 3.56 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.314 0.645 . . . . 74.450000000000003 110.038 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.442 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 56.1 mt -74.87 104.54 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.596 0.758 . . . . 72.230000000000004 110.246 -177.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.4 t -81.29 108.69 14.79 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 123.443 0.697 . . . . 73.200000000000003 109.165 -178.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 53.3 mt -106.06 108.36 24.88 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 N-CA-C 107.348 -1.353 . . . . 73.109999999999999 107.348 175.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -94.71 166.01 12.21 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 108.725 -0.842 . . . . 73.519999999999996 108.725 175.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.46 ' HA ' HD11 ' A' ' 58' ' ' ILE . 30.7 p30 -70.9 -8.9 56.19 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 120.65 0.262 . . . . 62.350000000000001 111.548 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.3 p -85.56 -25.31 26.82 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.494 0.718 . . . . 70.109999999999999 110.928 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -86.39 70.68 10.51 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.254 0.622 . . . . 74.409999999999997 109.495 177.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -56.65 -37.45 70.79 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.529 -0.759 . . . . 71.120000000000005 111.025 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -53.08 -44.83 67.86 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.614 1.166 . . . . 75.420000000000002 111.734 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.6 mt -73.39 -30.39 63.24 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 116.084 -0.507 . . . . 63.329999999999998 111.659 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.46 HD11 ' HA ' ' A' ' 52' ' ' ASN . 77.6 mt -70.17 -43.47 78.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 123.648 0.779 . . . . 65.200000000000003 110.66 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -54.08 -39.52 66.4 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.647 0.779 . . . . 61.119999999999997 112.703 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -99.08 28.84 4.17 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 120.88 0.371 . . . . 74.439999999999998 111.907 -177.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.6 t -151.25 100.31 2.74 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 108.652 -0.869 . . . . 75.340000000000003 108.652 173.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -56.95 -38.34 72.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.769 0.828 . . . . 73.450000000000003 110.288 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.539 HD11 HD12 ' A' ' 105' ' ' LEU . 31.8 tp -59.91 -45.08 93.72 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 124.124 0.89 . . . . 65.450000000000003 110.492 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.61 -43.41 96.94 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.1 0.56 . . . . 64.150000000000006 111.645 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -56.29 -50.65 70.82 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 124.14 0.9 . . . . 70.219999999999999 110.758 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 18.1 mm100 -66.4 -39.03 88.77 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 124.299 1.0 . . . . 73.109999999999999 112.365 -177.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.439 HG21 HD21 ' A' ' 77' ' ' LEU . 77.8 mt -64.94 -50.61 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 122.561 0.344 . . . . 53.229999999999997 110.883 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -67.51 -31.43 71.54 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.696 0.398 . . . . 72.219999999999999 111.736 179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.8 tp -69.98 -53.59 17.05 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.04 0.536 . . . . 74.349999999999994 110.734 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -71.95 -29.32 64.14 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.672 -0.694 . . . . 64.230000000000004 111.205 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.645 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 37.9 m -132.29 93.23 26.34 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 123.119 0.568 . . . . 53.439999999999998 110.009 -176.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.29 -10.43 22.41 Favored 'Trans proline' 0 C--N 1.37 1.689 0 C-N-CA 122.981 2.454 . . . . 62.420000000000002 113.357 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -82.18 -3.05 90.69 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-O 119.988 -0.34 . . . . 64.209999999999994 113.407 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 91.7 t -77.18 121.73 30.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 C-N-CA 123.542 0.737 . . . . 75.010000000000005 109.66 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -74.47 -48.78 25.3 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.854 0.862 . . . . 74.430000000000007 109.706 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.8 t -162.5 154.81 19.02 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.401 -1.272 . . . . 45.43 110.717 -170.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.439 HD21 HG21 ' A' ' 67' ' ' ILE . 36.2 mt -108.35 158.11 17.79 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.096 1.359 . . . . 73.099999999999994 108.745 169.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.439 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.0 ttm -137.49 113.92 10.21 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.246 -1.02 . . . . 75.349999999999994 108.246 170.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.602 HD13 HD13 ' A' ' 84' ' ' LEU . 22.0 mm -88.91 118.55 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 N-CA-C 107.958 -1.127 . . . . 63.240000000000002 107.958 -175.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -108.51 -164.21 20.86 Favored Glycine 0 C--O 1.242 0.652 0 N-CA-C 111.852 -0.499 . . . . 75.450000000000003 111.852 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -73.13 -74.68 0.16 Allowed 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.302 -0.999 . . . . 70.450000000000003 108.302 174.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -87.48 -19.79 27.46 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.088 1.355 . . . . 74.140000000000001 111.122 -176.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -119.77 160.49 22.49 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.808 0.67 . . . . 74.239999999999995 112.808 -164.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 79' ' ' ILE . 28.3 tp -135.99 109.77 8.11 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.415 -1.266 . . . . 73.010000000000005 107.803 170.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.439 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 36.9 m -96.21 108.44 20.91 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.317 -0.623 . . . . 74.239999999999995 109.317 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 26.3 mm -90.67 127.56 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 108.984 -0.747 . . . . 55.420000000000002 108.984 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -107.8 128.52 54.67 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 108.011 -1.107 . . . . 55.549999999999997 108.011 178.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.6 170.25 16.25 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.75 0.82 . . . . 74.530000000000001 110.106 178.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -85.26 134.78 34.12 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 109.515 -0.55 . . . . 74.319999999999993 109.515 173.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.2 ptp180 -55.1 -31.31 61.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.31 1.044 . . . . 70.129999999999995 113.656 -174.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 84.0 mtp -67.49 -26.79 66.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 122.721 0.408 . . . . 74.109999999999999 111.146 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 18.6 t -89.41 136.5 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 107.902 -1.147 . . . . 73.0 107.902 173.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -91.85 150.51 21.02 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.899 0.48 . . . . 73.219999999999999 111.537 -173.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -68.09 -15.71 63.71 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.243 0.617 . . . . 71.209999999999994 110.49 169.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -57.7 -31.01 65.97 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.115 0.966 . . . . 73.409999999999997 111.555 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.9 t -103.19 -17.12 15.49 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.406 0.682 . . . . 71.219999999999999 111.405 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.645 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 68.3 mt -100.96 -58.64 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 122.961 0.504 . . . . 70.540000000000006 111.13 -171.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.503 ' HD2' HG21 ' A' ' 21' ' ' THR . 27.7 ttpp -59.92 -46.24 98.2 Favored Pre-proline 0 CA--C 1.567 1.602 0 N-CA-C 114.606 1.336 . . . . 70.120000000000005 114.606 -170.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -60.29 -35.16 92.61 Favored 'Trans proline' 0 C--N 1.396 3.057 0 CA-C-N 122.002 1.751 . . . . 72.349999999999994 112.02 178.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -66.74 -46.45 75.39 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.463 -0.79 . . . . 63.420000000000002 109.837 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.41 ' O ' HD13 ' A' ' 105' ' ' LEU . 50.1 mt -67.42 -45.86 84.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 O-C-N 123.979 0.799 . . . . 74.329999999999998 111.528 -177.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.69 -40.67 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 122.746 0.418 . . . . 73.439999999999998 110.694 178.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -64.27 -41.28 96.99 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.894 0.746 . . . . 64.420000000000002 110.91 177.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.5 -36.84 85.49 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.639 0.776 . . . . 62.350000000000001 111.398 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.539 HD12 HD11 ' A' ' 63' ' ' LEU . 8.2 mp -69.25 -33.4 73.2 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.477 0.711 . . . . 61.130000000000003 109.939 175.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.9 m -71.27 -34.6 70.85 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.176 0.59 . . . . 61.130000000000003 109.642 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -69.09 -56.64 7.09 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 122.975 0.51 . . . . 64.129999999999995 110.266 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.92 -42.94 85.85 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.681 1.192 . . . . 71.310000000000002 111.24 -173.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.518 HD22 ' HB3' ' A' ' 38' ' ' GLU . 95.8 mt -73.42 -34.82 65.67 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.123 0.569 . . . . 72.540000000000006 111.418 178.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.16 -29.27 68.12 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 122.965 0.506 . . . . 71.150000000000006 111.35 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -74.3 -34.55 63.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.802 -0.635 . . . . 71.349999999999994 110.063 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.15 35.55 53.03 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-N 115.535 -0.757 . . . . 72.109999999999999 112.358 -179.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -98.74 -179.93 4.46 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.642 0.777 . . . . 72.409999999999997 110.705 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -87.81 143.38 27.17 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.936 0.494 . . . . 74.450000000000003 110.04 174.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 CA--C 1.546 0.794 0 N-CA-C 109.341 -0.614 . . . . 75.049999999999997 109.341 171.082 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.7 mp . . . . . 0 CA--C 1.545 0.784 0 CA-C-O 121.432 0.634 . . . . 64.010000000000005 112.042 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.1 m80 -87.71 137.28 32.47 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 125.108 1.363 . . . . 63.119999999999997 109.393 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.404 ' HB ' HG23 ' A' ' 102' ' ' ILE . 51.5 mm -121.76 117.16 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 107.019 -1.474 . . . . 73.329999999999998 107.019 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.527 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.8 ttmm -90.62 138.0 31.91 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.465 -0.939 . . . . 73.530000000000001 108.465 -178.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 85.2 m -105.55 124.61 49.84 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 108.395 -0.965 . . . . 65.450000000000003 108.395 174.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.6 mt -117.54 136.26 53.37 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 108.747 -0.834 . . . . 73.150000000000006 108.747 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.3 p -68.06 144.68 54.99 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.854 0.862 . . . . 73.430000000000007 110.432 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.3 p -126.2 147.84 61.18 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.364 1.066 . . . . 71.430000000000007 109.312 -173.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.94 -28.91 66.81 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 122.537 2.158 . . . . 64.439999999999998 112.033 171.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -87.16 117.23 25.77 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.196 0.999 . . . . 45.420000000000002 108.718 176.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -73.82 -29.78 62.34 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.535 0.734 . . . . 74.450000000000003 112.342 -175.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -74.35 -26.36 60.09 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 122.644 0.378 . . . . 73.109999999999999 110.588 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -90.11 158.91 17.06 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.411 0.684 . . . . 65.140000000000001 110.856 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.3 tp -158.67 123.13 4.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.335 -0.987 . . . . 64.140000000000001 108.335 168.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -84.22 129.95 34.86 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.041 0.936 . . . . 65.219999999999999 110.636 -174.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -118.57 118.56 32.01 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.257 1.023 . . . . 73.040000000000006 108.512 174.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.527 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 60.6 tp -100.88 124.65 46.87 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 109.218 -0.66 . . . . 74.329999999999998 109.218 -172.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.0 m -80.92 105.37 12.09 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.453 -0.943 . . . . 74.349999999999994 108.453 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 57.2 p -91.52 -6.16 52.97 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 112.943 0.719 . . . . 63.039999999999999 112.943 -168.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -97.15 178.02 5.39 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.075 0.95 . . . . 72.099999999999994 109.442 178.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.42 -11.72 29.16 Favored Glycine 0 N--CA 1.48 1.613 0 N-CA-C 114.208 0.443 . . . . 61.409999999999997 114.208 -175.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.471 ' HB3' HD22 ' A' ' 109' ' ' LEU . 11.4 mp0 -81.23 89.02 6.01 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.52 1.128 . . . . 72.439999999999998 109.832 175.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.7 ttt -93.53 136.45 33.8 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 108.063 -1.088 . . . . 61.340000000000003 108.063 172.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.405 ' HB3' HG11 ' A' ' 115' ' ' VAL . 77.5 mt -68.53 -59.51 3.09 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.933 0.493 . . . . 71.540000000000006 112.106 -167.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.534 ' HB2' ' HA ' ' A' ' 81' ' ' ASP . 26.3 mt-30 . . . . . 0 N--CA 1.482 1.162 0 C-N-CA 123.721 0.808 . . . . 70.310000000000002 109.46 172.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.3 m . . . . . 0 N--CA 1.475 0.788 0 CA-C-O 120.855 0.36 . . . . 73.129999999999995 110.584 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -94.64 132.47 39.32 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 108.385 -0.969 . . . . 73.200000000000003 108.385 173.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.3 p -70.01 115.71 9.53 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.661 0.785 . . . . 64.030000000000001 110.217 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.1 mt -74.33 102.02 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 109.017 -0.734 . . . . 74.430000000000007 109.017 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 89.7 t -91.65 106.97 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.604 -0.888 . . . . 60.340000000000003 108.604 -179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.508 HG12 ' HB3' ' A' ' 57' ' ' LEU . 66.4 mt -104.39 110.0 29.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 N-CA-C 108.065 -1.087 . . . . 60.43 108.065 -178.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' HB3' ' A' ' 76' ' ' SER . 54.1 mtmt -91.34 161.24 15.1 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.247 -0.649 . . . . 71.109999999999999 109.247 177.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.451 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 27.6 p30 -63.64 -18.27 63.76 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.0 0.92 . . . . 72.019999999999996 112.307 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -82.85 -27.17 31.0 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.67 0.788 . . . . 62.210000000000001 111.735 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.445 ' O ' HG13 ' A' ' 58' ' ' ILE . 31.1 m-20 -83.67 77.17 9.91 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.519 0.728 . . . . 72.420000000000002 111.601 -173.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -49.68 -46.31 49.78 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.196 0.998 . . . . 52.420000000000002 112.084 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -54.19 -48.02 71.43 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.495 1.118 . . . . 75.230000000000004 111.467 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.508 ' HB3' HG12 ' A' ' 50' ' ' ILE . 83.6 mt -73.6 -28.96 62.1 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 115.525 -0.761 . . . . 73.129999999999995 111.347 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.487 HG22 ' HG2' ' A' ' 65' ' ' GLN . 87.9 mt -70.81 -39.32 75.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 123.508 0.723 . . . . 63.43 110.393 178.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -66.16 -23.55 66.49 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.556 0.342 . . . . 74.439999999999998 111.516 174.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -72.05 -10.68 60.11 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 112.869 0.692 . . . . 75.329999999999998 112.869 172.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.4 m -140.83 105.31 4.87 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 122.841 0.456 . . . . 74.439999999999998 110.513 -177.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -59.31 -32.8 70.39 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.62 0.768 . . . . 74.450000000000003 110.401 174.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.2 tp -60.3 -44.73 95.15 Favored 'General case' 0 C--N 1.356 0.849 0 C-N-CA 123.988 0.915 . . . . 35.450000000000003 110.876 175.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.94 99.47 Favored 'General case' 0 C--N 1.357 0.906 0 O-C-N 123.845 0.715 . . . . 61.119999999999997 110.511 -178.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.487 ' HG2' HG22 ' A' ' 58' ' ' ILE . 82.8 mt-30 -57.4 -43.89 84.06 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 124.509 1.13 . . . . 72.0 110.862 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -69.23 -39.29 78.61 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 123.569 0.543 . . . . 53.130000000000003 112.026 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.461 HG21 HD21 ' A' ' 77' ' ' LEU . 59.8 mt -64.99 -49.07 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.435 0.694 . . . . 61.130000000000003 110.658 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -69.88 -27.23 64.64 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.121 0.568 . . . . 73.430000000000007 111.602 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 66.6 tp -69.66 -48.52 59.54 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.141 0.576 . . . . 74.430000000000007 110.845 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.415 HE22 HD21 ' A' ' 104' ' ' LEU . 73.8 mt-30 -74.48 -33.37 62.85 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.432 -0.804 . . . . 64.25 111.442 -177.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 52.4 t -142.95 94.18 6.48 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 108.759 -0.83 . . . . 74.340000000000003 108.759 -178.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -71.44 -2.01 10.61 Favored 'Trans proline' 0 C--N 1.373 1.851 0 C-N-CA 123.245 2.63 . . . . 75.409999999999997 112.733 174.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.69 -20.24 74.34 Favored Glycine 0 C--N 1.355 1.608 0 N-CA-C 111.687 -0.565 . . . . 74.25 111.687 177.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 85.9 t -65.39 118.3 7.68 Favored 'Isoleucine or valine' 0 C--N 1.354 0.789 0 C-N-CA 123.649 0.78 . . . . 62.229999999999997 109.713 175.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.451 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 40.5 mt-10 -82.15 -41.98 19.69 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.205 1.002 . . . . 44.439999999999998 110.871 -175.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.509 ' HB3' ' HG2' ' A' ' 51' ' ' LYS . 74.6 p -159.14 165.53 33.57 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.632 0.73 . . . . 61.509999999999998 111.999 -175.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.461 HD21 HG21 ' A' ' 67' ' ' ILE . 46.5 mt -129.1 127.78 42.16 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 106.905 -1.517 . . . . 72.400000000000006 106.905 176.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.495 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.3 ttm -103.32 109.1 20.59 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 108.11 -1.07 . . . . 64.019999999999996 108.11 173.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.61 HD13 HD13 ' A' ' 84' ' ' LEU . 13.6 mm -84.29 103.8 11.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 107.046 -1.465 . . . . 71.400000000000006 107.046 177.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.97 -168.74 43.14 Favored Glycine 0 C--O 1.245 0.816 0 N-CA-C 111.617 -0.593 . . . . 71.450000000000003 111.617 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.534 ' HA ' ' HB2' ' A' ' 41' ' ' GLN . 1.9 m-20 -76.26 -61.63 1.88 Allowed 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.678 -0.86 . . . . 74.420000000000002 108.678 -178.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -97.04 -14.73 21.42 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.112 0.965 . . . . 72.140000000000001 111.361 -178.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -134.65 156.25 49.07 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.381 0.512 . . . . 61.100000000000001 112.381 -159.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.61 HD13 HD13 ' A' ' 79' ' ' ILE . 22.6 tp -125.14 114.97 19.73 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.889 1.275 . . . . 74.219999999999999 107.921 174.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.495 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 30.8 m -102.44 108.86 20.33 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.452 -0.944 . . . . 70.040000000000006 108.452 -178.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.0 mm -87.4 136.95 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 107.908 -1.145 . . . . 70.409999999999997 107.908 -178.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -123.07 126.43 47.07 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 108.657 -0.868 . . . . 71.140000000000001 108.657 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -129.01 167.43 17.48 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.333 0.653 . . . . 74.340000000000003 109.573 177.111 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -59.71 141.94 54.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.075 0.95 . . . . 63.210000000000001 110.01 174.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -54.38 -38.8 66.56 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.513 0.725 . . . . 73.25 112.275 -172.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 45.3 ttp -75.81 -28.13 58.21 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.618 0.767 . . . . 71.319999999999993 111.216 -175.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.405 HG12 HD11 ' A' ' 97' ' ' ILE . 44.3 t -72.04 134.47 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 N-CA-C 108.458 -0.942 . . . . 63.439999999999998 108.458 172.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -104.13 160.78 14.57 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.149 0.579 . . . . 75.409999999999997 110.929 -176.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -77.94 -13.78 59.76 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.471 1.109 . . . . 72.430000000000007 113.547 -175.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -64.56 -28.36 69.59 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.28 0.632 . . . . 75.209999999999994 111.919 -171.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.2 m -95.24 -23.93 17.02 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.779 0.832 . . . . 72.519999999999996 111.546 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.405 HD11 HG12 ' A' ' 92' ' ' VAL . 50.7 mt -89.98 -48.93 14.13 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 123.813 0.845 . . . . 73.549999999999997 111.294 -168.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -51.62 -55.51 29.05 Favored Pre-proline 0 N--CA 1.487 1.395 0 CA-C-O 117.428 -1.272 . . . . 74.209999999999994 113.282 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -59.85 -38.19 81.33 Favored 'Trans proline' 0 C--N 1.396 3.049 0 CA-C-N 121.577 1.599 . . . . 63.100000000000001 112.314 -175.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.45 -48.03 57.86 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.049 0.54 . . . . 61.240000000000002 110.523 -175.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 13.1 mt -69.95 -45.23 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.49 0.716 . . . . 63.210000000000001 111.186 -178.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.404 HG23 ' HB ' ' A' ' 19' ' ' ILE . 58.1 mt -58.41 -37.4 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.067 0.547 . . . . 74.420000000000002 110.813 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -67.84 -45.77 73.7 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 123.687 0.617 . . . . 60.509999999999998 110.279 175.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.415 HD21 HE22 ' A' ' 70' ' ' GLN . 84.5 mt -60.11 -33.74 72.53 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 123.867 0.867 . . . . 71.099999999999994 111.588 177.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.5 mp -74.05 -35.34 64.3 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.171 0.988 . . . . 65.049999999999997 110.654 178.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 85.5 m -72.07 -31.19 65.87 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 109.293 -0.632 . . . . 43.450000000000003 109.293 178.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.535 ' HA ' ' HE2' ' A' ' 107' ' ' LYS . 10.1 mmpt? -73.32 -52.96 12.02 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 123.932 0.893 . . . . 62.520000000000003 111.101 175.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -55.7 -53.14 60.3 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.783 0.833 . . . . 74.439999999999998 111.043 -178.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.471 HD22 ' HB3' ' A' ' 38' ' ' GLU . 78.7 mt -74.12 -10.8 59.98 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 114.844 -1.071 . . . . 73.420000000000002 111.417 -176.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.84 -27.4 62.87 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.706 0.402 . . . . 45.32 110.845 170.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -79.62 -52.04 8.49 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 107.51 -1.293 . . . . 75.439999999999998 107.51 168.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.82 -8.6 75.16 Favored Glycine 0 C--N 1.354 1.582 0 N-CA-C 115.838 1.095 . . . . 75.150000000000006 115.838 163.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.18 -70.46 0.27 Allowed 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 117.669 0.734 . . . . 52.020000000000003 111.108 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -134.1 126.09 29.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.122 0.569 . . . . 72.219999999999999 110.762 -171.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.405 HG11 ' HB3' ' A' ' 40' ' ' LEU . 3.9 p . . . . . 0 N--CA 1.476 0.87 0 N-CA-C 107.997 -1.112 . . . . 62.340000000000003 107.997 158.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 106' ' ' THR . 74.7 mt . . . . . 0 CA--C 1.536 0.434 0 N-CA-C 108.941 -0.763 . . . . 73.450000000000003 108.941 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.454 ' H ' ' HB3' ' A' ' 36' ' ' ASP . 48.2 m80 -68.32 120.54 14.61 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 124.293 1.037 . . . . 71.239999999999995 110.848 -174.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.4 mm -118.19 123.71 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 N-CA-C 108.079 -1.082 . . . . 73.519999999999996 108.079 -173.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.526 ' HE3' HD21 ' A' ' 22' ' ' LEU . 56.6 tptt -96.78 112.27 24.09 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.684 1.194 . . . . 75.120000000000005 109.108 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.452 HG21 ' HE3' ' A' ' 98' ' ' LYS . 59.8 m -92.49 113.47 25.76 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 108.847 -0.797 . . . . 74.450000000000003 108.847 -178.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.526 HD21 ' HE3' ' A' ' 20' ' ' LYS . 95.4 mt -122.26 138.01 54.64 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.625 1.17 . . . . 64.230000000000004 109.591 -171.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.4 p -81.02 147.81 30.01 Favored 'General case' 0 C--O 1.24 0.56 0 O-C-N 124.073 0.858 . . . . 64.109999999999999 110.553 -178.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 36.6 p -125.38 158.0 65.76 Favored Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 124.136 0.974 . . . . 75.030000000000001 109.373 -174.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.13 -32.1 30.79 Favored 'Trans proline' 0 C--N 1.389 2.679 0 C-N-CA 123.289 2.66 . . . . 70.230000000000004 113.684 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -100.71 121.46 41.7 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 108.918 -0.771 . . . . 74.209999999999994 108.918 173.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -73.82 -15.37 61.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.112 0.565 . . . . 74.010000000000005 111.303 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.436 ' O ' ' HA ' ' A' ' 87' ' ' ASN . 13.2 m120 -71.9 -19.05 61.99 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 122.655 0.382 . . . . 52.450000000000003 110.609 170.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -102.41 159.7 15.19 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.56 1.144 . . . . 71.319999999999993 110.082 172.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.0 tp -160.28 120.91 2.96 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.14 -0.689 . . . . 71.439999999999998 109.14 176.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.9 ttmp? -82.44 120.75 25.86 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.044 0.538 . . . . 73.299999999999997 111.131 -176.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -105.24 111.86 24.76 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.381 -0.97 . . . . 71.140000000000001 108.381 169.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 59.5 tp -108.83 128.28 54.76 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.669 0.787 . . . . 62.310000000000002 109.665 -171.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 p -80.5 104.53 11.1 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.909 -0.774 . . . . 74.310000000000002 108.909 179.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.5 p -101.11 -6.74 23.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.743 0.817 . . . . 55.329999999999998 111.302 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . 0.454 ' HB3' ' H ' ' A' ' 18' ' ' HIS . 8.0 p-10 -69.44 -37.7 77.48 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.167 0.587 . . . . 75.430000000000007 110.316 177.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.31 -12.5 4.96 Favored Glycine 0 C--N 1.349 1.292 0 C-N-CA 123.371 0.51 . . . . 71.129999999999995 113.031 178.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.519 ' HG2' ' HB3' ' A' ' 109' ' ' LEU . 9.6 tp10 -78.04 149.03 34.06 Favored 'General case' 0 C--N 1.356 0.869 0 CA-C-N 117.567 0.683 . . . . 74.209999999999994 109.965 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 7.5 tpt -111.77 142.66 43.85 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.222 0.609 . . . . 72.439999999999998 109.992 -170.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.679 HD23 HD21 ' A' ' 109' ' ' LEU . 89.8 mt -86.0 -44.42 12.35 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.409 0.684 . . . . 74.450000000000003 111.378 -177.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.413 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.9 tp60 . . . . . 0 CA--C 1.561 1.376 0 N-CA-C 109.194 -0.669 . . . . 64.430000000000007 109.194 -177.278 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.2 t . . . . . 0 N--CA 1.476 0.847 0 CA-C-O 121.125 0.488 . . . . 40.229999999999997 109.817 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.28 -176.31 3.26 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.301 1.041 . . . . 71.439999999999998 110.185 177.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.5 m -73.49 92.88 1.93 Allowed 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 109.355 -0.609 . . . . 71.430000000000007 109.355 173.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.561 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 46.9 mt -75.35 97.87 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 108.758 -0.83 . . . . 65.400000000000006 108.758 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.4 t -86.83 107.27 16.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.017 -1.105 . . . . 74.329999999999998 108.017 -176.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.6 mt -102.59 108.4 24.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 107.884 -1.154 . . . . 72.109999999999999 107.884 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -95.66 155.96 16.53 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.195 0.598 . . . . 65.420000000000002 109.66 -176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.442 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 34.5 p30 -60.47 -18.87 54.27 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.563 0.745 . . . . 72.420000000000002 112.364 -178.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.5 p -77.56 -41.27 39.53 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.774 0.83 . . . . 61.210000000000001 111.262 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -86.69 79.75 8.77 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.502 0.721 . . . . 73.540000000000006 110.552 -171.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -66.53 -22.82 66.17 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.28 -0.873 . . . . 74.319999999999993 112.21 -173.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -57.5 -46.88 83.24 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 121.052 0.453 . . . . 73.010000000000005 110.377 178.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.3 mt -73.2 -35.65 66.38 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.662 0.785 . . . . 63.140000000000001 110.523 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.402 HG22 ' HG2' ' A' ' 65' ' ' GLN . 72.1 mt -61.27 -42.54 93.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.337 1.055 . . . . 51.130000000000003 110.283 177.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.433 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 83.1 m-20 -69.45 -29.19 66.83 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.159 0.584 . . . . 72.540000000000006 111.875 177.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -73.9 -33.14 63.88 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.142 0.577 . . . . 65.120000000000005 111.525 175.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.0 p -110.97 92.24 3.97 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 108.798 -0.816 . . . . 71.450000000000003 108.798 176.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -57.46 -23.4 49.61 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.718 0.807 . . . . 71.349999999999994 111.352 -175.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.405 HD11 HD12 ' A' ' 105' ' ' LEU . 62.4 tp -58.12 -46.73 85.09 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.062 1.345 . . . . 72.200000000000003 110.872 171.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.72 -39.27 93.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.939 0.896 . . . . 71.140000000000001 110.707 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.433 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 95.6 mt-30 -55.06 -47.84 74.31 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 123.651 0.594 . . . . 72.329999999999998 109.827 175.179 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -65.61 -45.31 83.64 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 115.135 -0.939 . . . . 74.099999999999994 112.845 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 69.2 mt -65.09 -49.1 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 123.112 0.565 . . . . 64.510000000000005 110.663 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -68.24 -30.12 69.1 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 116.107 -0.497 . . . . 75.409999999999997 111.372 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 41.0 tp -73.32 -46.99 46.17 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.107 0.563 . . . . 64.340000000000003 111.679 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.432 HE22 HD21 ' A' ' 104' ' ' LEU . 77.7 mt-30 -83.27 -17.42 42.65 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.316 0.647 . . . . 53.140000000000001 111.594 -173.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 51.6 t -141.96 105.58 5.73 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 123.352 0.661 . . . . 63.310000000000002 109.604 172.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.45 -8.53 22.77 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.949 2.433 . . . . 73.409999999999997 112.803 176.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.572 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -76.61 -21.9 73.78 Favored Glycine 0 C--N 1.345 1.037 0 CA-C-N 116.57 -0.286 . . . . 71.010000000000005 113.29 -178.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.53 122.68 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 122.989 0.516 . . . . 63.219999999999999 109.673 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.442 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 11.1 pt-20 -93.04 -33.77 13.97 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.755 0.822 . . . . 72.349999999999994 111.23 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.9 p -161.9 160.29 27.76 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.459 0.647 . . . . 63.439999999999998 112.023 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.411 HD22 HD12 ' A' ' 86' ' ' ILE . 40.7 mt -121.08 139.23 53.6 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.155 -1.424 . . . . 74.120000000000005 107.155 174.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.557 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 48.6 ttm -113.06 109.22 18.47 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 107.215 -1.402 . . . . 72.400000000000006 107.215 173.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.615 HG21 HG11 ' A' ' 115' ' ' VAL . 39.8 mm -92.49 127.18 44.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 109.342 -0.614 . . . . 72.209999999999994 109.342 -176.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -114.22 175.61 16.38 Favored Glycine 0 C--O 1.241 0.566 0 N-CA-C 109.677 -1.369 . . . . 41.240000000000002 109.677 166.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.413 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 23.5 m-20 -72.71 -44.61 61.5 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.582 0.706 . . . . 65.230000000000004 110.468 177.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -104.38 -39.51 6.42 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 125.014 1.326 . . . . 65.200000000000003 110.933 -174.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 18.1 p90 -111.21 155.58 22.73 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.292 0.637 . . . . 53.310000000000002 111.201 -175.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.46 HD21 HD11 ' A' ' 86' ' ' ILE . 54.3 tp -120.79 150.45 40.99 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 107.425 -1.324 . . . . 74.430000000000007 107.425 171.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 50.7 m -141.37 109.46 5.81 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.218 0.607 . . . . 43.450000000000003 109.76 175.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.499 HG13 HD13 ' A' ' 101' ' ' ILE . 29.5 mm -88.76 139.53 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 109.242 -0.651 . . . . 61.409999999999997 109.242 -178.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . 0.436 ' HA ' ' O ' ' A' ' 28' ' ' ASN . 33.5 m-80 -118.35 133.82 55.56 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.454 0.702 . . . . 74.319999999999993 109.571 175.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.486 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -128.11 168.74 14.95 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.585 0.754 . . . . 71.319999999999993 109.978 -178.832 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 14.1 t70 -72.95 149.5 43.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.274 0.63 . . . . 71.549999999999997 110.179 173.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -50.14 -41.04 48.09 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.653 1.181 . . . . 65.439999999999998 114.184 -172.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 20.0 ptp -83.41 -18.03 40.14 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 122.752 0.421 . . . . 75.340000000000003 111.75 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.572 HG11 ' HA3' ' A' ' 73' ' ' GLY . 27.4 t -81.46 127.65 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.068 0.547 . . . . 72.439999999999998 109.545 -171.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -86.8 130.68 34.37 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.785 0.834 . . . . 74.209999999999994 110.601 -169.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.486 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 45.4 m95 -59.16 -31.41 68.96 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.507 0.723 . . . . 71.310000000000002 112.141 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -61.35 -26.19 67.66 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 122.767 0.427 . . . . 73.349999999999994 111.445 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.7 t -86.99 -18.73 29.97 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.698 0.799 . . . . 44.32 111.367 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.5 HD11 HG12 ' A' ' 92' ' ' VAL . 10.9 mt -104.09 -44.16 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.348 0 C-N-CA 123.043 0.537 . . . . 73.409999999999997 111.586 -170.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.452 ' HE3' HG21 ' A' ' 21' ' ' THR . 54.5 mtpt -52.91 -52.18 67.46 Favored Pre-proline 0 N--CA 1.491 1.595 0 C-N-CA 124.963 1.305 . . . . 74.239999999999995 113.706 -172.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -56.5 -40.07 87.0 Favored 'Trans proline' 0 C--N 1.393 2.919 0 C-N-CA 121.909 1.74 . . . . 74.239999999999995 112.049 -178.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.4 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 10.8 mm-40 -61.84 -53.76 51.44 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.79 -1.096 . . . . 75.310000000000002 110.03 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.499 HD13 HG13 ' A' ' 86' ' ' ILE . 48.2 mt -61.93 -51.06 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.077 0.951 . . . . 75.109999999999999 111.833 -176.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 83.2 mt -58.56 -40.17 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 123.308 0.643 . . . . 73.299999999999997 110.824 -177.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -66.99 -42.51 84.9 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.944 0.498 . . . . 63.240000000000002 110.74 178.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.432 HD21 HE22 ' A' ' 70' ' ' GLN . 90.7 mt -65.79 -35.57 81.08 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.163 0.985 . . . . 63.509999999999998 111.757 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.405 HD12 HD11 ' A' ' 63' ' ' LEU . 6.5 mp -62.36 -35.94 80.69 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.687 0.795 . . . . 63.310000000000002 109.95 174.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.541 ' HA ' HD12 ' A' ' 17' ' ' ILE . 26.3 m -74.26 -29.83 61.85 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.073 0.549 . . . . 63.240000000000002 110.054 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -65.53 -52.41 52.81 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.456 0.702 . . . . 65.120000000000005 110.31 174.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -66.88 -52.62 41.24 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.306 -0.861 . . . . 73.420000000000002 111.744 -174.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.679 HD21 HD23 ' A' ' 40' ' ' LEU . 95.4 mt -67.56 -18.03 64.86 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.551 -0.75 . . . . 61.130000000000003 111.528 -174.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.33 -19.4 65.45 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.717 0.807 . . . . 71.420000000000002 112.032 174.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -74.73 -29.23 61.1 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.992 0.517 . . . . 62.32 110.434 173.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.97 28.04 63.32 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.947 -0.57 . . . . 74.329999999999998 112.85 -177.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -115.81 -178.65 3.44 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.216 1.006 . . . . 62.119999999999997 110.064 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -70.14 169.47 13.49 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.189 0.596 . . . . 62.340000000000003 110.336 172.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.615 HG11 HG21 ' A' ' 79' ' ' ILE . 7.1 p . . . . . 0 N--CA 1.477 0.905 0 C-N-CA 123.896 0.878 . . . . 63.329999999999998 109.707 175.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.7 mt . . . . . 0 N--CA 1.475 0.824 0 CA-C-O 120.949 0.404 . . . . 62.009999999999998 110.747 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -77.31 112.92 14.53 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.254 1.021 . . . . 72.540000000000006 110.627 -175.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.448 ' HB ' HG23 ' A' ' 102' ' ' ILE . 50.1 mm -121.63 119.24 58.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 106.69 -1.596 . . . . 72.340000000000003 106.69 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -112.25 130.88 55.78 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.843 -1.169 . . . . 73.219999999999999 107.843 178.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.1 m -111.01 112.58 24.5 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.469 -0.567 . . . . 71.420000000000002 109.469 -175.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -97.62 139.67 33.17 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 123.396 0.678 . . . . 70.109999999999999 109.95 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 64.5 p -84.65 150.79 24.9 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.765 0.826 . . . . 74.450000000000003 110.223 -176.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 54.4 p -126.66 145.85 54.8 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.589 0.756 . . . . 63.140000000000001 109.587 -174.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -52.74 -41.08 71.99 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 123.203 2.602 . . . . 50.329999999999998 113.246 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -73.53 111.9 9.1 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.2 0.6 . . . . 60.439999999999998 109.858 172.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -71.99 -16.99 62.08 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.239 1.016 . . . . 65.0 112.368 -172.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -89.73 6.75 40.13 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.737 0.815 . . . . 61.119999999999997 111.5 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -135.47 159.34 41.9 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.391 1.077 . . . . 61.539999999999999 109.353 174.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.9 tp -156.86 127.55 6.66 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.314 -0.625 . . . . 74.519999999999996 109.314 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.54 114.7 26.97 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.367 0.667 . . . . 72.230000000000004 111.258 -173.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -103.19 125.35 49.83 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.748 1.219 . . . . 74.510000000000005 108.2 170.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.5 tp -130.71 136.69 49.02 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.501 0.72 . . . . 75.409999999999997 109.34 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.4 m -91.05 112.41 24.3 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.77 -0.826 . . . . 72.510000000000005 108.77 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.2 p -75.9 -5.74 47.56 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.249 0.62 . . . . 64.439999999999998 112.423 -174.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -71.0 -31.26 67.74 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.174 0.59 . . . . 65.430000000000007 110.141 169.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.96 36.28 3.23 Favored Glycine 0 C--N 1.344 1.01 0 CA-C-N 115.475 -0.784 . . . . 72.540000000000006 111.986 -174.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.404 ' HB3' HD22 ' A' ' 109' ' ' LEU . 22.7 mm-40 -83.71 81.87 8.57 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.545 0.688 . . . . 74.329999999999998 109.449 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 52.2 ttm -74.67 133.14 42.13 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 114.97 -1.013 . . . . 64.310000000000002 109.871 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 84' ' ' LEU . 75.4 mt -78.12 -57.67 3.66 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.238 0.615 . . . . 72.519999999999996 110.494 -174.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.523 ' HB2' ' HA ' ' A' ' 81' ' ' ASP . 10.1 mm100 . . . . . 0 CA--C 1.554 1.112 0 C-N-CA 124.387 1.075 . . . . 73.349999999999994 109.143 -177.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 73.7 m . . . . . 0 N--CA 1.481 1.105 0 CA-C-O 120.978 0.418 . . . . 73.530000000000001 111.779 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.2 mmpt? -87.82 154.07 20.84 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.103 0.961 . . . . 73.540000000000006 110.329 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.4 m -77.65 91.9 4.06 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.571 0.748 . . . . 52.509999999999998 109.63 177.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.438 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 64.5 mt -73.47 109.15 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.311 1.044 . . . . 65.25 109.678 -175.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.2 t -87.04 110.06 19.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 109.225 -0.657 . . . . 71.150000000000006 109.225 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.416 HG23 ' HB2' ' A' ' 57' ' ' LEU . 76.0 mt -106.61 107.83 23.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 107.556 -1.275 . . . . 65.409999999999997 107.556 174.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -92.37 165.26 13.16 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 109.68 -0.489 . . . . 74.299999999999997 109.68 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -64.79 -24.46 67.56 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.507 0.723 . . . . 75.409999999999997 111.759 178.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.0 t -79.48 -22.88 43.47 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.403 0.681 . . . . 74.239999999999995 110.672 176.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -90.16 63.18 5.73 Favored 'General case' 0 C--N 1.354 0.771 0 C-N-CA 123.604 0.762 . . . . 63.219999999999999 109.894 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.478 ' HA ' HD12 ' A' ' 58' ' ' ILE . 38.1 tt0 -65.45 -23.82 67.02 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.897 -0.592 . . . . 75.349999999999994 110.466 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -61.67 -40.65 95.7 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.092 0.957 . . . . 62.310000000000002 111.278 175.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.416 ' HB2' HG23 ' A' ' 50' ' ' ILE . 96.0 mt -71.86 -41.38 68.16 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.273 0.629 . . . . 74.099999999999994 110.007 176.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.478 HD12 ' HA ' ' A' ' 55' ' ' GLU . 79.9 mt -59.2 -37.76 70.48 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 124.356 1.062 . . . . 73.120000000000005 111.103 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -58.47 -34.43 70.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.48 0.712 . . . . 74.25 111.699 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 53.0 m80 -94.95 13.71 24.07 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.031 0.932 . . . . 75.439999999999998 111.525 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.4 m -138.4 96.51 3.18 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.726 0.81 . . . . 53.009999999999998 109.793 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -55.73 -44.89 77.94 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.549 1.139 . . . . 73.030000000000001 112.388 -177.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.583 ' HB3' HG23 ' A' ' 115' ' ' VAL . 51.1 tp -61.1 -39.52 90.26 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.355 -0.839 . . . . 75.349999999999994 111.464 177.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.65 -43.52 96.52 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.906 0.483 . . . . 73.030000000000001 111.396 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -56.29 -47.56 78.41 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 123.993 0.808 . . . . 53.32 110.612 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.55 ' HB3' HD22 ' A' ' 104' ' ' LEU . 27.2 mm-40 -62.14 -44.98 95.43 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.754 0.822 . . . . 65.340000000000003 113.09 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.422 HG21 HD21 ' A' ' 77' ' ' LEU . 81.3 mt -65.13 -49.93 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.255 0.622 . . . . 75.209999999999994 110.863 -177.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -69.56 -26.21 64.38 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 111.988 0.366 . . . . 74.099999999999994 111.988 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.8 tp -72.5 -60.09 2.4 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 122.993 0.517 . . . . 63.439999999999998 111.268 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -81.35 -21.57 39.03 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.765 -0.652 . . . . 70.219999999999999 111.398 -171.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.521 ' SG ' HG23 ' A' ' 97' ' ' ILE . 60.1 m -124.44 92.73 47.6 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 123.612 0.765 . . . . 74.239999999999995 109.472 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.03 -10.75 26.51 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 123.004 2.47 . . . . 73.129999999999995 113.337 -177.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.441 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -100.6 46.63 1.32 Allowed Glycine 0 C--N 1.348 1.244 0 C-N-CA 122.759 0.219 . . . . 32.210000000000001 112.721 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 94.8 t -122.26 125.34 72.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 123.742 0.817 . . . . 74.319999999999993 109.187 170.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -87.82 -42.43 12.56 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.76 0.424 . . . . 75.150000000000006 111.158 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.1 t -152.98 165.51 35.33 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.061 0.458 . . . . 52.229999999999997 111.272 -172.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.422 HD21 HG21 ' A' ' 67' ' ' ILE . 79.1 mt -128.62 130.02 46.7 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 124.61 1.164 . . . . 71.25 108.143 175.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.542 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.7 ttm -107.72 101.88 11.15 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.53 -1.285 . . . . 61.399999999999999 107.53 174.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.438 ' HB ' ' HB ' ' A' ' 48' ' ' ILE . 45.8 mm -83.55 100.69 7.31 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 108.221 -1.029 . . . . 63.340000000000003 108.221 -176.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -83.06 172.06 51.09 Favored Glycine 0 C--O 1.248 0.973 0 N-CA-C 109.715 -1.354 . . . . 72.319999999999993 109.715 174.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.523 ' HA ' ' HB2' ' A' ' 41' ' ' GLN . 10.9 p-10 -70.07 -51.76 29.29 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 110.122 -0.325 . . . . 74.109999999999999 110.122 -178.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -99.58 -39.82 8.12 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.229 0.612 . . . . 70.329999999999998 109.847 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -95.76 163.03 13.35 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.522 0.729 . . . . 74.349999999999994 111.67 -170.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.54 ' HB2' HD11 ' A' ' 40' ' ' LEU . 67.3 tp -130.03 113.42 14.53 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.747 -0.834 . . . . 64.439999999999998 108.747 175.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.542 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 51.3 m -105.69 109.93 22.06 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.207 -0.664 . . . . 63.25 109.207 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.419 HG13 HG21 ' A' ' 101' ' ' ILE . 28.9 mm -87.83 133.76 29.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 107.77 -1.196 . . . . 74.310000000000002 107.77 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -114.44 134.0 55.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.417 0.687 . . . . 72.019999999999996 109.32 -177.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.457 ' NZ ' HD12 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -140.07 174.6 10.35 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.432 0.634 . . . . 75.019999999999996 111.426 175.285 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -86.49 147.73 25.85 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.917 -1.038 . . . . 70.030000000000001 109.08 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.6 ptt180 -76.81 -1.94 30.75 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 112.826 0.676 . . . . 75.209999999999994 112.826 -173.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 66.9 mtt -79.35 -24.49 42.68 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 109.854 -0.424 . . . . 73.209999999999994 109.854 172.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.441 HG11 ' HA3' ' A' ' 73' ' ' GLY . 60.1 t -98.29 142.27 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.909 0.883 . . . . 55.119999999999997 108.717 177.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -88.82 142.35 27.74 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.864 0.866 . . . . 74.310000000000002 111.556 -175.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.407 ' CD2' ' HE2' ' A' ' 88' ' ' LYS . 52.7 m95 -71.54 -45.37 62.51 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.967 0.507 . . . . 71.510000000000005 111.064 172.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -50.44 -32.21 17.22 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 124.56 1.144 . . . . 74.319999999999993 112.572 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.4 m -73.97 -54.32 8.16 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-N 115.467 -0.788 . . . . 75.040000000000006 110.839 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.521 HG23 ' SG ' ' A' ' 71' ' ' CYS . 10.5 mt -81.33 -22.4 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 124.318 1.047 . . . . 75.030000000000001 112.376 -170.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.69 -50.57 84.7 Favored Pre-proline 0 CA--C 1.557 1.246 0 C-N-CA 124.316 1.046 . . . . 74.409999999999997 113.512 -168.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -62.3 -28.44 78.85 Favored 'Trans proline' 0 C--N 1.385 2.49 0 C-N-CA 121.564 1.509 . . . . 65.329999999999998 111.97 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -70.68 -40.31 73.02 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.973 0.909 . . . . 71.040000000000006 111.219 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.419 HG21 HG13 ' A' ' 86' ' ' ILE . 71.4 mt -68.99 -45.9 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 N-CA-C 109.811 -0.44 . . . . 73.450000000000003 109.811 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.448 HG23 ' HB ' ' A' ' 19' ' ' ILE . 88.4 mt -53.57 -40.63 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.585 0.754 . . . . 54.119999999999997 110.597 175.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -74.37 -37.57 63.41 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.523 -0.762 . . . . 43.0 111.505 -179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.55 HD22 ' HB3' ' A' ' 66' ' ' GLN . 48.8 mt -64.75 -33.43 75.96 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.662 0.785 . . . . 64.310000000000002 111.6 175.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.36 -25.03 62.2 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.716 -0.675 . . . . 74.340000000000003 110.275 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 26.0 m -79.85 -33.76 39.91 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 109.05 -0.722 . . . . 63.509999999999998 109.05 176.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -64.67 -50.57 66.52 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.285 0.634 . . . . 74.420000000000002 111.08 175.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.519 ' HG3' ' HB2' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -68.16 -56.13 9.87 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.98 0.912 . . . . 75.25 110.431 -173.216 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 113' ' ' GLU . 66.9 mt -67.76 -11.96 59.54 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.679 0.792 . . . . 62.109999999999999 112.527 -173.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.07 -39.59 93.44 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.263 0.625 . . . . 60.219999999999999 110.386 173.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -94.26 -37.7 11.39 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.488 -0.778 . . . . 71.209999999999994 110.516 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.55 160.33 26.92 Favored Glycine 0 C--N 1.349 1.295 0 N-CA-C 114.243 0.457 . . . . 41.109999999999999 114.243 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.472 ' HA ' HD23 ' A' ' 109' ' ' LEU . 0.2 OUTLIER -86.29 -16.98 35.82 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.429 1.092 . . . . 74.329999999999998 111.604 179.904 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -67.3 107.95 2.57 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.345 0.658 . . . . 51.240000000000002 111.262 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.583 HG23 ' HB3' ' A' ' 63' ' ' LEU . 2.9 p . . . . . 0 CA--C 1.555 1.153 0 CA-C-N 115.459 -0.791 . . . . 74.200000000000003 109.91 170.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.58 HG21 ' HB2' ' A' ' 109' ' ' LEU . 1.6 mp . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 107.328 -1.36 . . . . 64.120000000000005 107.328 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -67.65 131.73 46.15 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.284 -0.871 . . . . 73.319999999999993 109.224 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.559 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.7 mm -112.78 124.9 69.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 N-CA-C 105.975 -1.861 . . . . 61.210000000000001 105.975 -178.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HD3' HD23 ' A' ' 33' ' ' LEU . 51.3 tttp -90.75 159.7 16.19 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.318 -1.364 . . . . 71.25 107.318 -179.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.499 HG21 ' HE3' ' A' ' 98' ' ' LYS . 41.2 m -137.83 133.17 33.63 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.893 -0.78 . . . . 75.519999999999996 108.893 176.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.541 HD11 HD22 ' A' ' 33' ' ' LEU . 50.6 mt -117.48 139.23 51.2 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 107.474 -1.306 . . . . 51.439999999999998 107.474 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 62.5 p -69.98 155.79 40.06 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 122.64 0.376 . . . . 61.329999999999998 110.296 175.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.0 p -131.35 149.53 73.86 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 124.31 1.044 . . . . 61.32 108.94 -177.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.3 -9.61 26.31 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 122.538 2.158 . . . . 55.32 113.308 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.435 HD22 ' N ' ' A' ' 29' ' ' ALA . 7.9 t30 -101.02 128.33 47.1 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.42 0.688 . . . . 71.150000000000006 109.446 174.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -68.0 -35.87 79.04 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.544 1.137 . . . . 73.019999999999996 113.315 -175.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -78.43 -16.01 58.04 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.993 0.517 . . . . 62.240000000000002 111.111 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.437 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -102.23 151.44 22.21 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.823 0.849 . . . . 51.109999999999999 110.155 -178.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.9 tp -160.74 118.82 2.49 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 108.112 -1.07 . . . . 72.329999999999998 108.112 172.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -90.69 130.91 36.64 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 121.489 0.662 . . . . 53.530000000000001 110.531 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -104.13 119.62 39.35 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 107.249 -1.389 . . . . 74.519999999999996 107.249 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.541 HD22 HD11 ' A' ' 22' ' ' LEU . 23.6 tp -98.54 123.47 42.73 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.517 -0.92 . . . . 73.019999999999996 108.517 -172.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.4 m -90.53 105.78 18.05 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 108.47 -0.937 . . . . 73.450000000000003 108.47 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.5 t -136.83 8.06 3.0 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 115.745 -0.661 . . . . 70.530000000000001 111.416 -174.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -145.63 141.25 27.98 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.146 -1.057 . . . . 74.319999999999993 108.146 175.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.564 ' HA3' HG13 ' A' ' 17' ' ' ILE . . . 81.91 -90.05 1.45 Allowed Glycine 0 C--N 1.34 0.79 0 N-CA-C 110.816 -0.914 . . . . 65.540000000000006 110.816 -173.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -134.26 -179.59 5.66 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.128 0.971 . . . . 63.310000000000002 109.958 178.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 12.3 ptp -111.88 162.14 15.62 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.128 0.971 . . . . 70.340000000000003 108.422 161.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.418 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 74.4 mt -70.66 -38.71 73.83 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.783 0.833 . . . . 64.409999999999997 111.731 -175.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.728 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.6 tt0 . . . . . 0 CA--C 1.542 0.664 0 N-CA-C 107.735 -1.209 . . . . 75.319999999999993 107.735 -178.161 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.6 t . . . . . 0 CA--C 1.554 1.109 0 N-CA-C 110.064 -0.347 . . . . 73.230000000000004 110.064 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.4 178.61 5.56 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.597 1.159 . . . . 72.109999999999999 111.513 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 55.2 m -91.79 128.91 37.8 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.892 0.877 . . . . 53.450000000000003 109.818 173.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 mp -96.74 119.52 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 124.197 0.999 . . . . 75.239999999999995 109.016 -178.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -91.49 110.33 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 CA-C-N 118.447 0.567 . . . . 73.319999999999993 109.786 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.1 mt -101.95 109.74 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.46 1.104 . . . . 74.230000000000004 108.81 176.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -93.12 151.05 20.09 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.214 0.606 . . . . 73.5 109.882 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.469 ' HA ' HD11 ' A' ' 58' ' ' ILE . 47.3 p30 -66.95 -24.32 66.06 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.387 0.675 . . . . 73.540000000000006 112.137 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.8 t -84.52 -7.07 59.39 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.975 0.91 . . . . 60.020000000000003 112.008 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -111.66 88.7 2.86 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.272 0.629 . . . . 73.239999999999995 109.795 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.44 -35.26 51.85 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.273 1.029 . . . . 75.209999999999994 111.653 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -57.3 -53.39 58.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.511 1.124 . . . . 74.239999999999995 111.094 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.8 -34.41 78.28 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.417 -0.81 . . . . 71.200000000000003 111.231 -176.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.517 HG22 ' HG2' ' A' ' 65' ' ' GLN . 66.6 mt -70.09 -47.33 68.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.188 0.995 . . . . 74.030000000000001 110.217 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -62.29 -19.33 63.15 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.473 1.109 . . . . 53.43 112.683 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -69.25 -54.86 12.56 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-O 121.334 0.587 . . . . 74.329999999999998 109.732 172.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.3 m -94.67 107.82 19.81 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.103 -0.953 . . . . 72.219999999999999 110.478 -172.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 38.7 ttpt -59.1 -33.27 70.63 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.018 0.527 . . . . 73.239999999999995 109.741 174.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.417 HD11 HD12 ' A' ' 105' ' ' LEU . 30.6 tp -59.23 -46.52 88.25 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.619 1.167 . . . . 71.219999999999999 110.637 177.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.09 -47.02 84.49 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 123.85 0.86 . . . . 55.439999999999998 110.658 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.517 ' HG2' HG22 ' A' ' 58' ' ' ILE . 65.9 mt-30 -59.1 -39.94 83.77 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 124.58 1.175 . . . . 74.209999999999994 110.967 -178.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.547 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 17.0 mm100 -66.73 -45.77 77.59 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 118.513 -0.756 . . . . 63.130000000000003 110.891 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -58.33 -43.61 86.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 CA-C-N 118.63 0.65 . . . . 63.130000000000003 110.68 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -68.58 -32.79 72.95 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.387 0.675 . . . . 74.409999999999997 111.342 175.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.6 tp -68.16 -34.8 76.99 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.439 0.696 . . . . 74.200000000000003 110.817 175.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.547 ' HG2' ' O ' ' A' ' 66' ' ' GLN . 7.1 mm100 -75.16 -41.31 58.4 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 120.983 0.421 . . . . 75.340000000000003 110.007 -178.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 61.0 m -151.43 100.57 2.97 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 124.136 0.974 . . . . 53.340000000000003 108.503 -176.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -67.25 1.95 2.61 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 123.381 2.721 . . . . 74.129999999999995 114.349 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.58 -5.42 89.92 Favored Glycine 0 C--N 1.352 1.457 0 CA-C-O 119.749 -0.473 . . . . 71.450000000000003 113.544 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.1 t -74.09 127.04 35.69 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 123.063 0.545 . . . . 74.450000000000003 110.243 177.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -84.79 -45.5 12.3 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.934 0.894 . . . . 54.32 110.874 -177.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.9 p -156.92 166.2 34.02 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.789 0.804 . . . . 71.040000000000006 110.923 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.1 mt -126.18 127.62 45.98 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 107.157 -1.423 . . . . 74.129999999999995 107.157 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.615 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.3 ttm -103.56 96.75 6.94 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 106.989 -1.485 . . . . 71.010000000000005 106.989 173.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 29.4 mm -77.88 101.01 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 114.893 -1.049 . . . . 51.399999999999999 108.685 -175.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.88 174.24 44.07 Favored Glycine 0 C--O 1.247 0.967 0 N-CA-C 110.31 -1.116 . . . . 64.140000000000001 110.31 176.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.728 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 2.5 m-20 -76.64 -56.67 4.4 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.791 0.805 . . . . 55.219999999999999 109.808 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -101.9 -7.79 22.15 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.474 -1.239 . . . . 65.129999999999995 111.114 -174.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -139.9 172.32 12.94 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.452 0.701 . . . . 74.549999999999997 110.654 -176.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.418 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 35.7 tp -143.75 106.93 4.52 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.872 0.469 . . . . 75.219999999999999 110.13 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.615 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 61.0 m -95.8 103.49 15.38 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.851 -0.796 . . . . 65.129999999999995 108.851 -176.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.632 HG13 HD13 ' A' ' 101' ' ' ILE . 15.7 mm -87.88 122.55 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.554 -0.906 . . . . 72.010000000000005 108.554 -177.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -108.35 113.57 26.75 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 108.153 -1.054 . . . . 74.129999999999995 108.153 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.74 177.55 5.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.45 0.7 . . . . 74.430000000000007 110.446 -175.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -77.16 136.85 38.61 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.184 0.593 . . . . 75.030000000000001 110.109 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -67.74 -22.18 65.24 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 112.86 0.689 . . . . 70.439999999999998 112.86 -171.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 71.8 mtm -79.81 -22.89 42.51 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.866 0.466 . . . . 54.149999999999999 110.888 176.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 38.5 t -89.56 141.72 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.028 -1.101 . . . . 73.540000000000006 108.028 176.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 68.7 m80 -110.9 157.24 20.09 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.612 0.597 . . . . 74.319999999999993 112.612 -171.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -70.74 -25.22 62.83 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.19 0.996 . . . . 71.239999999999995 112.93 -176.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -59.2 -24.87 63.48 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 120.977 0.417 . . . . 71.519999999999996 111.043 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 17.8 m -88.87 -42.29 11.94 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.283 1.033 . . . . 74.349999999999994 111.739 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.517 HG22 HD11 ' A' ' 101' ' ' ILE . 7.6 mt -91.33 -50.02 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 122.905 0.482 . . . . 72.340000000000003 111.039 -165.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.499 ' HE3' HG21 ' A' ' 21' ' ' THR . 85.8 tttt -50.95 -51.36 67.96 Favored Pre-proline 0 CA--C 1.566 1.561 0 N-CA-C 114.509 1.3 . . . . 74.310000000000002 114.509 -174.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -57.26 -35.15 98.85 Favored 'Trans proline' 0 C--N 1.398 3.143 0 C-N-CA 121.884 1.723 . . . . 73.519999999999996 112.147 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.427 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 26.0 mm-40 -67.53 -46.02 74.01 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.159 -0.928 . . . . 73.239999999999995 110.268 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.632 HD13 HG13 ' A' ' 86' ' ' ILE . 76.7 mt -61.53 -47.11 94.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.611 0.764 . . . . 50.350000000000001 110.565 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.559 HG23 ' HB ' ' A' ' 19' ' ' ILE . 76.8 mt -57.86 -45.55 87.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 123.659 0.599 . . . . 74.409999999999997 110.25 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -59.37 -48.0 83.3 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.851 0.86 . . . . 74.299999999999997 111.273 178.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 95.7 mt -62.88 -40.0 96.18 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.033 0.933 . . . . 73.310000000000002 111.726 -178.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.417 HD12 HD11 ' A' ' 63' ' ' LEU . 9.4 mp -71.74 -27.9 63.31 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.758 0.823 . . . . 70.400000000000006 110.933 178.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 97.5 m -74.25 -47.01 37.89 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.922 0.489 . . . . 74.340000000000003 109.775 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -76.15 -34.6 59.4 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.399 -0.819 . . . . 73.319999999999993 111.357 -174.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.665 ' HG3' ' HB2' ' A' ' 113' ' ' GLU . 30.8 tt0 -59.31 -55.34 36.09 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.92 0.488 . . . . 63.149999999999999 109.997 175.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.58 ' HB2' HG21 ' A' ' 17' ' ' ILE . 80.9 mt -73.43 -16.95 61.3 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.299 -0.864 . . . . 65.319999999999993 111.119 -175.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.35 -46.3 70.51 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.347 0.659 . . . . 72.040000000000006 110.407 171.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.499 ' HB2' ' HG3' ' A' ' 113' ' ' GLU . 18.8 m-85 -73.79 -19.22 60.83 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 115.963 -0.562 . . . . 73.019999999999996 110.155 173.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.57 44.4 26.7 Favored Glycine 0 C--N 1.35 1.358 0 N-CA-C 111.584 -0.607 . . . . 74.340000000000003 111.584 -179.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.665 ' HB2' ' HG3' ' A' ' 108' ' ' GLN . 44.0 mt-10 -88.69 174.9 7.76 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.747 0.819 . . . . 55.32 111.25 -177.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -109.85 128.21 55.19 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 124.685 1.194 . . . . 73.409999999999997 108.928 -178.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 5.1 p . . . . . 0 CA--C 1.546 0.802 0 N-CA-C 107.591 -1.262 . . . . 71.239999999999995 107.591 165.378 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.415 ' O ' HG12 ' A' ' 19' ' ' ILE . 67.6 mt . . . . . 0 C--O 1.238 0.468 0 N-CA-C 107.357 -1.349 . . . . 74.510000000000005 107.357 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -67.51 105.42 1.83 Allowed 'General case' 0 C--O 1.241 0.644 0 CA-C-O 121.494 0.664 . . . . 75.319999999999993 110.25 -171.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 17' ' ' ILE . 49.8 mm -118.79 109.95 28.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 N-CA-C 106.378 -1.712 . . . . 74.200000000000003 106.378 -176.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -92.87 119.48 32.23 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 108.678 -0.86 . . . . 74.510000000000005 108.678 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.9 t -92.55 118.79 31.37 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.734 -0.839 . . . . 62.219999999999999 108.734 -178.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.4 mt -124.58 140.7 52.7 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.331 1.052 . . . . 71.329999999999998 109.19 -173.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 17.9 p -82.09 152.96 26.33 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 122.77 0.428 . . . . 70.400000000000006 110.595 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.7 p -114.4 169.94 6.01 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.119 0.968 . . . . 63.130000000000003 108.645 -178.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -59.63 -12.22 16.92 Favored 'Trans proline' 0 C--N 1.381 2.252 0 C-N-CA 122.487 2.124 . . . . 62.210000000000001 113.598 168.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.494 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 84.0 m-20 -95.0 151.49 19.12 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.203 1.001 . . . . 64.409999999999997 110.701 176.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -82.86 -45.26 14.46 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.265 0.626 . . . . 71.129999999999995 109.966 174.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -92.52 29.95 1.62 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.067 0.947 . . . . 64.219999999999999 111.048 -174.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -139.45 127.6 22.49 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.9 0.88 . . . . 74.530000000000001 108.769 171.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.9 tp -129.1 125.64 37.61 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.869 -1.159 . . . . 70.329999999999998 107.869 174.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -82.62 133.05 35.18 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.094 0.958 . . . . 73.510000000000005 110.588 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -117.01 122.96 45.71 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 107.885 -1.154 . . . . 73.209999999999994 107.885 171.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.7 tp -118.31 130.56 56.1 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.422 0.689 . . . . 73.0 111.099 -169.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 p -90.11 120.95 31.73 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 108.538 -0.912 . . . . 73.239999999999995 108.538 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 60.0 p -108.9 -26.95 9.97 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 113.669 0.988 . . . . 75.209999999999994 113.669 -164.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -72.32 -37.65 68.86 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 118.113 0.415 . . . . 74.409999999999997 110.599 -175.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 157.18 1.24 0.1 OUTLIER Glycine 0 C--N 1.345 1.037 0 CA-C-O 119.514 -0.604 . . . . 34.32 114.218 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.524 ' HB3' HD22 ' A' ' 109' ' ' LEU . 18.6 mp0 -79.77 84.84 5.51 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.365 0.666 . . . . 74.299999999999997 110.879 -171.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 79.7 mtp -77.72 124.81 28.43 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.118 0.485 . . . . 75.010000000000005 110.457 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.585 ' HB3' HG12 ' A' ' 115' ' ' VAL . 95.6 mt -65.64 -33.23 75.41 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 125.142 1.377 . . . . 71.109999999999999 112.209 -177.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.576 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 29.1 tt0 . . . . . 0 CA--C 1.544 0.728 0 C-N-CA 124.81 1.244 . . . . 74.109999999999999 107.76 -174.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 63.8 m . . . . . 0 CA--C 1.539 0.549 0 N-CA-C 109.157 -0.682 . . . . 54.409999999999997 109.157 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -62.12 145.88 52.08 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.014 0.526 . . . . 74.329999999999998 111.665 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.1 m -63.05 113.09 2.91 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.107 0.963 . . . . 73.209999999999994 111.441 -174.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.6 mt -80.85 116.1 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 123.607 0.763 . . . . 70.219999999999999 110.365 -174.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 64.4 t -91.55 108.26 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 N-CA-C 109.082 -0.71 . . . . 64.439999999999998 109.082 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.416 ' HB ' ' HB2' ' A' ' 77' ' ' LEU . 73.3 mt -96.45 110.28 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 108.066 -1.087 . . . . 63.43 108.066 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.4 mtmp? -92.52 161.66 14.53 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.869 0.467 . . . . 74.049999999999997 110.279 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.9 p30 -65.58 -25.82 67.57 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 113.736 1.013 . . . . 74.109999999999999 113.736 -175.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.0 p -84.9 -12.1 54.15 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.384 0.274 . . . . 62.039999999999999 111.462 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -82.89 68.97 9.59 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.32 0.648 . . . . 73.450000000000003 110.043 -177.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -49.26 -39.33 30.09 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.504 1.522 . . . . 71.219999999999999 111.648 176.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 39.6 t-20 -60.23 -50.13 74.89 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.568 1.147 . . . . 63.149999999999999 110.568 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 71.2 mt -74.73 -28.93 60.99 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.855 0.462 . . . . 55.100000000000001 111.559 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 82.8 mt -67.14 -49.2 75.19 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 N-CA-C 109.224 -0.658 . . . . 61.109999999999999 109.224 174.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -66.54 -24.42 66.37 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.121 0.415 . . . . 63.520000000000003 112.121 177.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -79.77 -24.74 41.31 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 112.022 0.379 . . . . 60.520000000000003 112.022 175.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.9 t -114.97 108.52 16.81 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 109.747 -0.464 . . . . 73.430000000000007 109.747 177.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -64.54 -31.64 72.94 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.057 0.543 . . . . 63.149999999999999 110.778 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.524 ' HB2' ' NE2' ' A' ' 108' ' ' GLN . 58.6 tp -60.74 -41.63 95.77 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.517 0.727 . . . . 72.129999999999995 110.599 173.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -57.65 -47.39 82.4 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.837 0.455 . . . . 42.520000000000003 110.459 177.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -59.17 -44.77 92.16 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.077 -0.965 . . . . 70.230000000000004 110.571 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -59.75 -53.33 59.22 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.811 0.844 . . . . 71.120000000000005 112.488 177.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.689 HG22 HG21 ' A' ' 74' ' ' VAL . 59.6 mt -65.51 -39.82 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 123.084 0.554 . . . . 63.25 111.143 -174.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -66.78 -31.03 71.4 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.337 0.655 . . . . 74.140000000000001 111.51 174.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.3 tp -70.85 -52.78 18.22 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.872 0.469 . . . . 72.349999999999994 110.744 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -69.79 -29.23 66.49 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.321 -0.854 . . . . 74.209999999999994 110.894 -174.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.628 ' SG ' HG23 ' A' ' 97' ' ' ILE . 82.3 m -144.61 96.33 5.2 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 108.884 -0.784 . . . . 54.25 108.884 176.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -63.87 -4.57 7.54 Favored 'Trans proline' 0 N--CA 1.5 1.911 0 C-N-CA 123.276 2.651 . . . . 73.239999999999995 114.315 175.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.523 ' HA3' HG21 ' A' ' 92' ' ' VAL . . . -86.99 8.64 75.56 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-O 119.555 -0.581 . . . . 70.230000000000004 113.794 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.689 HG21 HG22 ' A' ' 67' ' ' ILE . 99.9 t -69.79 124.74 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.192 0.597 . . . . 64.310000000000002 110.073 173.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.05 -56.6 3.39 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.905 -0.776 . . . . 72.5 108.905 -179.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 61.1 m -147.74 167.92 23.43 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 115.768 -0.651 . . . . 61.32 110.891 -178.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.416 ' HB2' ' HB ' ' A' ' 50' ' ' ILE . 77.3 mt -127.16 148.54 50.17 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.535 1.134 . . . . 71.549999999999997 109.097 176.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.539 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.0 ttm -126.17 111.02 14.13 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 108.051 -1.092 . . . . 54.549999999999997 108.051 169.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.0 mm -89.35 103.01 13.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 108.37 -0.974 . . . . 71.439999999999998 108.37 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.9 176.81 41.22 Favored Glycine 0 C--O 1.243 0.671 0 N-CA-C 111.5 -0.64 . . . . 75.140000000000001 111.5 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.576 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 3.9 m-20 -69.96 -60.28 2.4 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.737 0.779 . . . . 61.409999999999997 109.611 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.23 -17.28 14.52 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.82 -1.082 . . . . 72.040000000000006 110.302 -177.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -118.63 167.99 11.12 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.363 0.665 . . . . 73.030000000000001 111.556 -171.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 31.8 tp -141.3 142.59 33.85 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.512 0.725 . . . . 75.439999999999998 109.326 175.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.539 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 86.8 m -131.03 118.15 20.17 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.289 0.636 . . . . 64.120000000000005 109.685 174.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 19.7 mm -108.77 108.17 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 109.922 -0.399 . . . . 63.25 109.922 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -83.15 146.62 28.54 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.382 0.673 . . . . 71.209999999999994 110.53 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.776 ' HE2' HG21 ' A' ' 97' ' ' ILE . 34.6 mmtm -123.51 171.59 9.39 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.893 0.877 . . . . 72.010000000000005 110.322 173.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.65 149.13 32.94 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.891 -1.151 . . . . 62.43 107.891 163.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -62.79 -24.44 67.74 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.432 0.693 . . . . 73.230000000000004 112.599 -175.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 21.5 ptm -73.13 -18.79 61.25 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.059 0.544 . . . . 50.399999999999999 111.822 -177.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.523 HG21 ' HA3' ' A' ' 73' ' ' GLY . 8.5 t -100.98 137.14 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.64 0.776 . . . . 63.200000000000003 109.811 -175.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -97.76 148.52 23.28 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.541 0.736 . . . . 73.140000000000001 111.733 -174.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -74.41 -36.43 63.47 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.941 1.296 . . . . 75.530000000000001 113.306 -173.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -52.57 -29.04 23.58 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.333 1.053 . . . . 60.5 113.241 -173.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.7 p -83.07 -36.51 24.84 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.399 0.68 . . . . 74.329999999999998 110.676 -178.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.776 HG21 ' HE2' ' A' ' 88' ' ' LYS . 48.2 mt -89.6 -29.53 5.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 CA-C-N 115.118 -0.946 . . . . 72.140000000000001 112.196 -164.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -53.3 -53.43 56.23 Favored Pre-proline 0 CA--C 1.562 1.426 0 CA-C-O 117.766 -1.111 . . . . 72.420000000000002 112.546 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.87 -31.94 94.56 Favored 'Trans proline' 0 C--N 1.395 3.015 0 C-N-CA 121.927 1.752 . . . . 72.450000000000003 112.51 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -64.01 -52.75 58.06 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.37 0.419 . . . . 71.439999999999998 111.272 177.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 67.5 mt -66.58 -43.7 90.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 122.989 0.515 . . . . 73.450000000000003 110.828 -176.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 93.5 mt -58.54 -40.41 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 122.89 0.476 . . . . 64.319999999999993 110.49 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.17 -46.99 75.45 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 123.326 0.391 . . . . 71.430000000000007 111.046 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.1 mt -62.31 -34.88 77.46 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.526 0.73 . . . . 73.420000000000002 111.469 -179.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.66 -35.43 70.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.46 0.704 . . . . 72.219999999999999 110.555 175.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 92.3 m -72.9 -32.75 65.57 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.638 -0.504 . . . . 64.519999999999996 109.638 179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -66.7 -57.2 7.62 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.573 0.749 . . . . 72.200000000000003 110.129 174.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.524 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 26.2 tt0 -53.28 -55.58 23.5 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.062 0.945 . . . . 75.420000000000002 111.637 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 38' ' ' GLU . 76.8 mt -68.87 -15.85 63.61 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 124.162 0.914 . . . . 63.350000000000001 111.609 -174.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -80.34 -20.44 44.19 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.292 0.637 . . . . 50.240000000000002 111.628 175.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -100.93 -28.19 12.89 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.217 0.607 . . . . 74.019999999999996 110.664 175.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.14 140.96 3.66 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.898 -0.592 . . . . 65.439999999999998 111.805 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -59.69 -33.83 72.1 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.898 0.879 . . . . 74.530000000000001 111.857 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -75.77 133.52 40.68 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.344 0.592 . . . . 74.540000000000006 111.822 -173.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.585 HG12 ' HB3' ' A' ' 40' ' ' LEU . 3.1 p . . . . . 0 N--CA 1.467 0.403 0 N-CA-C 107.889 -1.152 . . . . 62.520000000000003 107.889 158.078 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.532 ' HB ' HG23 ' A' ' 106' ' ' THR . 93.0 mt . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 109.745 -0.465 . . . . 64.310000000000002 109.745 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -84.67 135.46 34.15 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.1 0.56 . . . . 63.200000000000003 110.028 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.54 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.7 mm -128.78 122.23 56.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 107.522 -1.288 . . . . 60.409999999999997 107.522 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -101.6 125.44 48.26 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.288 1.035 . . . . 72.219999999999999 108.629 -176.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . 0.545 HG21 ' HE3' ' A' ' 98' ' ' LYS . 28.8 m -105.53 111.22 23.84 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.594 -0.891 . . . . 64.430000000000007 108.594 -179.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.0 mt -100.43 139.35 36.23 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.966 0.906 . . . . 73.120000000000005 111.112 -174.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.2 p -70.48 130.4 41.77 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 124.372 1.045 . . . . 64.129999999999995 110.165 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 43.5 p -118.21 152.76 51.03 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 123.177 0.591 . . . . 63.310000000000002 110.185 -174.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.86 8.33 3.49 Favored 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 122.911 2.407 . . . . 64.450000000000003 112.615 172.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -90.42 123.57 34.25 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.333 1.053 . . . . 73.420000000000002 109.073 -178.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.509 ' HG2' HD22 ' A' ' 28' ' ' ASN . 45.5 tt0 -77.87 130.77 37.04 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.399 0.68 . . . . 74.239999999999995 110.731 -177.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.509 HD22 ' HG2' ' A' ' 27' ' ' GLU . 51.2 m-80 59.1 25.11 13.51 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.637 1.175 . . . . 71.150000000000006 112.263 -173.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.507 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -142.02 139.48 32.37 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.382 0.673 . . . . 72.109999999999999 109.686 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.4 tp -148.34 138.04 22.25 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.733 0.413 . . . . 72.310000000000002 110.555 -173.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -85.9 123.78 31.63 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.374 0.669 . . . . 75.219999999999999 111.814 -174.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -110.34 110.6 21.45 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 107.174 -1.417 . . . . 51.409999999999997 107.174 170.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.3 tp -106.08 129.62 54.14 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.331 1.052 . . . . 70.450000000000003 110.24 -167.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.9 m -77.51 104.99 8.36 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.995 -0.743 . . . . 72.120000000000005 108.995 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.5 p -113.09 10.56 18.73 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.552 0.741 . . . . 64.25 111.278 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -75.34 -26.7 58.8 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.379 0.672 . . . . 64.439999999999998 110.902 -179.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.71 -36.96 1.92 Allowed Glycine 0 C--N 1.334 0.419 0 N-CA-C 110.395 -1.082 . . . . 70.430000000000007 110.395 -176.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -78.2 161.41 27.34 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 122.026 0.917 . . . . 74.040000000000006 111.446 174.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 85.0 mtp -117.97 142.53 47.26 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 106.376 -1.713 . . . . 62.329999999999998 106.376 170.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 82.5 mt -55.29 -45.22 76.24 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.842 0.457 . . . . 71.040000000000006 112.021 -175.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 33.2 tt0 . . . . . 0 C--O 1.243 0.737 0 C-N-CA 124.333 1.053 . . . . 75.25 108.789 -177.025 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 121.27 0.557 . . . . 75.400000000000006 111.009 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -120.05 178.02 4.77 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 108.115 -1.069 . . . . 53.229999999999997 108.115 168.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.1 p -87.87 71.8 9.44 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.603 -1.258 . . . . 64.340000000000003 107.603 167.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.568 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 55.9 mt -72.42 104.49 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 115.323 -0.853 . . . . 51.210000000000001 109.817 -167.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 77' ' ' LEU . 60.2 t -87.63 109.59 19.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.806 -0.813 . . . . 53.039999999999999 108.806 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.442 HG23 ' HB2' ' A' ' 57' ' ' LEU . 52.5 mt -109.41 112.37 40.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 108.674 -0.862 . . . . 71.120000000000005 108.674 178.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.5 mtpt -86.47 162.01 18.31 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 109.39 -0.596 . . . . 73.420000000000002 109.39 173.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.8 p-10 -59.06 -24.75 63.15 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.41 1.084 . . . . 72.239999999999995 112.332 178.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.1 t -81.63 -18.23 45.39 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.073 0.549 . . . . 52.130000000000003 111.196 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.0 68.28 7.23 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.971 0.908 . . . . 73.219999999999999 111.115 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -60.02 -27.27 66.76 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.453 0.701 . . . . 73.319999999999993 110.994 176.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -60.37 -40.21 90.02 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 122.927 0.491 . . . . 72.120000000000005 111.355 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.442 ' HB2' HG23 ' A' ' 50' ' ' ILE . 87.1 mt -81.24 -35.7 30.88 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.808 0.843 . . . . 60.100000000000001 111.748 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 83.0 mt -63.22 -35.09 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.771 0.828 . . . . 44.399999999999999 109.836 176.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -63.02 -28.1 69.87 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.755 1.222 . . . . 42.149999999999999 111.663 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -82.02 -7.35 59.61 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.48 0.712 . . . . 72.310000000000002 111.926 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.2 t -135.74 101.77 4.87 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.895 0.478 . . . . 73.329999999999998 111.013 -171.08 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -54.76 -36.32 64.73 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.241 0.616 . . . . 52.140000000000001 110.648 170.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.567 ' HB2' ' HG3' ' A' ' 108' ' ' GLN . 27.2 tp -63.61 -44.08 95.0 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.261 0.624 . . . . 73.019999999999996 111.155 177.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.03 98.07 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.901 0.48 . . . . 55.329999999999998 111.099 179.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -54.43 -48.41 71.69 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 124.144 0.902 . . . . 53.140000000000001 110.475 175.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.544 ' HB3' HD22 ' A' ' 104' ' ' LEU . 27.9 mm-40 -63.68 -41.08 98.2 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.167 0.987 . . . . 73.349999999999994 113.101 178.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.544 HG21 HD21 ' A' ' 77' ' ' LEU . 95.9 mt -64.68 -53.22 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.472 0.709 . . . . 72.340000000000003 111.164 -178.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -68.49 -27.75 66.4 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 123.415 0.447 . . . . 71.5 111.416 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -66.55 -58.58 4.9 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.182 0.593 . . . . 54.140000000000001 110.739 177.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.467 ' NE2' HD21 ' A' ' 104' ' ' LEU . 78.7 mt-30 -79.21 -26.59 42.55 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.765 -0.652 . . . . 62.049999999999997 112.139 -174.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 79.5 m -133.08 86.85 41.29 Favored Pre-proline 0 CA--C 1.548 0.891 0 N-CA-C 108.904 -0.776 . . . . 62.130000000000003 108.904 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.88 -7.08 19.56 Favored 'Trans proline' 0 C--N 1.369 1.641 0 C-N-CA 122.933 2.422 . . . . 65.230000000000004 112.644 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.23 -15.28 81.71 Favored Glycine 0 C--N 1.347 1.19 0 CA-C-N 116.221 -0.445 . . . . 65.140000000000001 113.138 178.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 68.0 t -73.39 121.8 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 108.683 -0.858 . . . . 52.100000000000001 108.683 174.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -90.95 -28.67 17.9 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 115.9 -0.591 . . . . 71.219999999999999 110.904 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.7 t -161.65 161.63 29.63 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.591 0.71 . . . . 73.040000000000006 111.536 -171.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.544 HD21 HG21 ' A' ' 67' ' ' ILE . 84.6 mt -126.06 150.94 47.78 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.734 1.214 . . . . 75.099999999999994 108.228 177.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.575 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.3 ttm -125.01 104.15 8.4 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.028 -1.471 . . . . 73.209999999999994 107.028 168.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.714 HD13 HD13 ' A' ' 84' ' ' LEU . 34.2 mm -86.82 132.76 31.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.524 -0.917 . . . . 72.239999999999995 108.524 -175.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -121.14 -170.58 14.05 Favored Glycine 0 C--O 1.245 0.834 0 N-CA-C 110.901 -0.88 . . . . 53.219999999999999 110.901 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.02 -55.06 16.05 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.04 0.924 . . . . 74.530000000000001 109.707 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -118.03 0.98 11.96 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.513 -1.221 . . . . 74.230000000000004 111.705 -172.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -140.52 166.26 25.21 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.351 0.596 . . . . 73.439999999999998 111.661 -170.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.714 HD13 HD13 ' A' ' 79' ' ' ILE . 17.3 tp -141.65 116.56 9.86 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 114.368 -1.287 . . . . 53.229999999999997 108.601 176.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.575 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 14.1 m -100.61 111.56 23.82 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.261 -1.015 . . . . 74.010000000000005 108.261 179.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 29' ' ' ALA . 43.2 mm -86.31 125.88 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 109.244 -0.65 . . . . 73.329999999999998 109.244 -174.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -110.57 118.7 36.94 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 107.976 -1.12 . . . . 65.450000000000003 107.976 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -130.37 170.86 13.6 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 120.953 0.406 . . . . 71.340000000000003 111.205 -174.075 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.417 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 16.6 t70 -71.7 148.99 45.89 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 115.092 -0.958 . . . . 74.329999999999998 110.638 174.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 18.1 ptp180 -62.69 -24.11 67.48 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.309 1.044 . . . . 74.019999999999996 113.03 -175.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 86.8 mtp -80.11 -14.75 58.26 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.847 0.459 . . . . 72.329999999999998 111.784 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.84 124.09 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.543 0.737 . . . . 62.0 109.262 -175.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -89.18 142.47 27.62 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.489 0.716 . . . . 62.549999999999997 110.749 -172.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -58.81 -33.75 70.73 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.832 0.853 . . . . 73.349999999999994 112.442 178.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -61.62 -23.59 66.14 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.206 0.602 . . . . 52.030000000000001 112.277 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 26.5 m -91.61 -17.89 24.86 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.463 0.705 . . . . 74.25 111.849 177.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 87.1 mt -96.29 -50.8 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.894 0.878 . . . . 74.230000000000004 111.198 -171.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.545 ' HE3' HG21 ' A' ' 21' ' ' THR . 57.7 mtpt -56.15 -57.51 22.0 Favored Pre-proline 0 CA--C 1.551 0.988 0 CA-C-O 117.436 -1.269 . . . . 74.329999999999998 113.565 -167.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -59.59 -36.51 92.4 Favored 'Trans proline' 0 C--N 1.395 2.999 0 C-N-CA 121.978 1.786 . . . . 60.119999999999997 111.842 -174.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 6.3 mm-40 -66.59 -49.83 65.05 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 114.917 -1.038 . . . . 65.439999999999998 110.928 -177.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 24.4 mt -75.48 -29.88 21.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 C-N-CA 123.209 0.604 . . . . 70.230000000000004 111.502 -175.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.54 HG23 ' HB ' ' A' ' 19' ' ' ILE . 93.7 mt -60.2 -42.54 90.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-O 121.108 0.48 . . . . 73.010000000000005 109.795 170.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -63.63 -40.06 95.92 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 114.926 -1.034 . . . . 72.409999999999997 110.852 176.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.544 HD22 ' HB3' ' A' ' 66' ' ' GLN . 98.5 mt -66.57 -38.37 86.91 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.622 0.769 . . . . 73.230000000000004 112.53 178.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.6 HD11 HD23 ' A' ' 84' ' ' LEU . 10.0 mp -65.38 -24.24 67.17 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.621 0.369 . . . . 41.439999999999998 110.802 174.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.532 HG23 ' HB ' ' A' ' 17' ' ' ILE . 89.2 m -81.69 -37.16 27.82 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.569 0.747 . . . . 72.049999999999997 109.612 177.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -63.21 -46.62 86.17 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.436 0.695 . . . . 70.099999999999994 111.138 175.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.567 ' HG3' ' HB2' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -64.09 -56.97 11.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.002 0.921 . . . . 65.109999999999999 110.3 -175.027 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.488 ' HB2' HD13 ' A' ' 17' ' ' ILE . 97.1 mt -68.54 -12.63 61.54 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 115.761 -0.654 . . . . 63.439999999999998 112.279 -176.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -88.06 -49.54 6.97 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.863 0.465 . . . . 74.439999999999998 111.268 174.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -92.49 -16.53 25.68 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.649 0.379 . . . . 75.129999999999995 111.855 -170.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -134.13 -135.66 3.57 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 110.893 -0.883 . . . . 41.049999999999997 110.893 -178.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -160.85 -60.18 0.06 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.613 0.765 . . . . 64.120000000000005 110.071 -175.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -92.44 141.9 28.02 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.738 0.815 . . . . 43.43 110.087 -178.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.505 HG21 HD12 ' A' ' 79' ' ' ILE . 6.0 p . . . . . 0 C--O 1.215 -0.711 0 N-CA-C 108.573 -0.899 . . . . 64.109999999999999 108.573 168.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.403 HG13 ' HB2' ' A' ' 109' ' ' LEU . 11.6 mm . . . . . 0 N--CA 1.471 0.61 0 CA-C-O 119.589 -0.243 . . . . 73.140000000000001 110.557 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . 0.488 ' HB2' ' O ' ' A' ' 35' ' ' THR . 5.0 m170 -87.89 138.05 31.79 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 107.728 -1.212 . . . . 72.019999999999996 107.728 174.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.521 ' HB ' HG23 ' A' ' 102' ' ' ILE . 51.4 mm -123.06 116.45 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 107.848 -1.168 . . . . 62.5 107.848 -176.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.606 ' HE3' HD21 ' A' ' 22' ' ' LEU . 62.6 tttp -100.12 125.77 46.27 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.167 1.387 . . . . 72.239999999999995 108.955 -172.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 89.5 m -93.77 112.01 23.8 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.679 -0.86 . . . . 63.520000000000003 108.679 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.606 HD21 ' HE3' ' A' ' 20' ' ' LYS . 93.9 mt -106.31 136.59 45.77 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 123.737 0.815 . . . . 75.239999999999995 109.49 177.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 34.6 p -89.16 143.25 26.98 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.635 0.774 . . . . 71.420000000000002 110.405 179.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.7 p -119.98 154.24 55.42 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 124.377 1.071 . . . . 74.230000000000004 109.278 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -49.7 -45.97 29.27 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 123.571 2.847 . . . . 74.109999999999999 113.244 176.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -77.85 114.99 17.25 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.818 0.847 . . . . 71.25 109.145 175.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.38 -19.35 59.6 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.864 0.466 . . . . 50.329999999999998 111.436 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -63.42 -27.18 69.12 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.914 0.886 . . . . 74.439999999999998 109.612 172.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.413 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -102.37 154.06 19.43 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.056 1.342 . . . . 75.420000000000002 110.94 176.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 tp -151.07 127.82 10.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.683 0.793 . . . . 70.150000000000006 108.884 170.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -90.17 138.19 31.73 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.326 0.65 . . . . 74.239999999999995 111.729 -174.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -123.49 126.25 46.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.699 1.2 . . . . 74.129999999999995 108.638 171.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.6 tp -117.05 125.72 51.76 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.269 1.027 . . . . 73.409999999999997 108.656 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.4 p -80.59 107.07 13.09 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 108.848 -0.797 . . . . 71.120000000000005 108.848 176.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . 0.488 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 26.0 p -106.87 127.43 53.41 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.009 1.324 . . . . 71.519999999999996 108.638 -177.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 57.99 73.79 0.45 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.349 1.06 . . . . 75.430000000000007 109.943 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -175.82 -130.05 1.28 Allowed Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 114.277 -1.328 . . . . 34.240000000000002 110.474 -176.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -129.4 156.26 44.36 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.818 0.847 . . . . 73.200000000000003 109.753 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 15.7 ttt -78.4 144.99 35.4 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.489 0.716 . . . . 61.130000000000003 110.776 -171.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' A' ' 84' ' ' LEU . 96.3 mt -70.73 -39.27 73.47 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.52 0.728 . . . . 71.040000000000006 112.2 -175.345 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.544 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.9 tp-100 . . . . . 0 CA--C 1.539 0.537 0 C-N-CA 123.949 0.899 . . . . 74.540000000000006 109.031 -176.254 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.7 m . . . . . 0 N--CA 1.477 0.916 0 CA-C-O 120.924 0.392 . . . . 63.25 111.678 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -94.99 -172.95 2.83 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.217 1.007 . . . . 75.030000000000001 109.881 175.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.6 p -72.56 101.26 2.95 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.542 0.737 . . . . 73.340000000000003 110.189 174.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 53.9 mt -78.51 102.53 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.445 0.698 . . . . 73.150000000000006 109.72 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 40.5 t -90.19 108.71 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 N-CA-C 109.036 -0.728 . . . . 54.450000000000003 109.036 -176.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 72.2 mt -98.36 109.14 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 N-CA-C 108.593 -0.891 . . . . 61.439999999999998 108.593 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -103.55 141.01 36.75 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.0 0.52 . . . . 73.219999999999999 110.007 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -62.37 -23.84 67.03 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.846 0.858 . . . . 54.420000000000002 112.842 -175.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.3 t -69.6 -35.62 75.48 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.35 0.66 . . . . 73.5 110.763 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -97.13 77.24 2.7 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 107.755 -1.202 . . . . 75.209999999999994 107.755 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.551 ' HA ' HD13 ' A' ' 58' ' ' ILE . 36.8 tt0 -66.34 -15.68 63.46 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.486 -0.779 . . . . 73.019999999999996 112.138 -172.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -63.35 -38.02 89.52 Favored 'General case' 0 C--N 1.35 0.623 0 N-CA-C 110.09 -0.337 . . . . 71.549999999999997 110.09 173.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.09 -36.43 84.27 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.593 0.757 . . . . 65.409999999999997 110.419 177.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.551 HD13 ' HA ' ' A' ' 55' ' ' GLU . 1.9 mp -61.73 -50.1 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 CA-C-N 115.063 -0.972 . . . . 54.240000000000002 109.026 173.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -65.87 -24.62 66.9 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.596 0.758 . . . . 64.140000000000001 112.016 -176.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 29.1 m170 -72.94 -39.07 66.54 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.795 0.438 . . . . 74.319999999999993 110.251 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.5 m -106.93 112.86 26.02 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.499 0.72 . . . . 74.239999999999995 111.614 -172.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -55.98 -39.09 71.3 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.201 0.6 . . . . 54.240000000000002 111.268 177.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.641 HD11 HD12 ' A' ' 105' ' ' LEU . 21.4 tp -61.62 -40.04 93.44 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 123.718 0.637 . . . . 70.120000000000005 111.065 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.409 ' HA ' HD11 ' A' ' 77' ' ' LEU . . . -65.94 -42.97 89.33 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.071 0.548 . . . . 64.109999999999999 111.003 179.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -55.89 -50.69 69.97 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.259 0.624 . . . . 75.439999999999998 109.947 176.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.494 ' HB3' HD22 ' A' ' 104' ' ' LEU . 26.7 mm-40 -59.31 -50.66 73.15 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.441 1.096 . . . . 73.430000000000007 112.613 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.0 mt -66.85 -51.28 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.354 0.662 . . . . 72.140000000000001 111.475 -174.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -67.18 -29.99 69.83 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.038 0.535 . . . . 74.439999999999998 111.827 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -70.07 -59.53 2.84 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-O 120.883 0.373 . . . . 72.230000000000004 110.814 176.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -82.75 -10.51 58.86 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.578 0.751 . . . . 72.120000000000005 111.984 -170.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.485 ' SG ' HG12 ' A' ' 97' ' ' ILE . 44.4 t -145.49 84.08 8.64 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 108.696 -0.853 . . . . 65.450000000000003 108.696 169.393 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -69.91 2.64 3.44 Favored 'Trans proline' 0 C--N 1.381 2.278 0 C-N-CA 123.195 2.597 . . . . 53.109999999999999 113.817 179.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . 0.506 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -84.39 -1.44 89.35 Favored Glycine 0 C--N 1.349 1.259 0 N-CA-C 114.168 0.427 . . . . 72.010000000000005 114.168 176.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 89.3 t -85.45 132.07 32.74 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 123.211 0.604 . . . . 64.409999999999997 109.443 174.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -84.01 -50.31 8.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.561 1.144 . . . . 71.0 110.875 176.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.8 p -155.02 155.5 34.27 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.61 -0.723 . . . . 73.120000000000005 110.955 -174.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.409 HD11 ' HA ' ' A' ' 64' ' ' ALA . 36.3 mt -106.85 148.58 28.37 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.378 -1.341 . . . . 74.120000000000005 107.378 170.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.57 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 50.6 ttm -125.32 101.08 6.8 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 106.6 -1.63 . . . . 74.150000000000006 106.6 167.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.78 HG21 HG11 ' A' ' 115' ' ' VAL . 18.2 mm -81.01 107.44 13.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 107.921 -1.14 . . . . 65.519999999999996 107.921 -178.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.53 170.38 36.88 Favored Glycine 0 C--O 1.245 0.805 0 N-CA-C 109.689 -1.364 . . . . 61.420000000000002 109.689 171.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.544 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 6.9 p-10 -59.64 -51.41 69.94 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 123.854 0.384 . . . . 73.439999999999998 110.588 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -107.2 -30.46 8.74 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.01 0.524 . . . . 63.329999999999998 111.121 177.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -99.2 161.22 13.74 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.2 0.6 . . . . 75.120000000000005 111.876 -172.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.486 ' HB2' HD13 ' A' ' 40' ' ' LEU . 26.3 tp -134.24 112.04 10.74 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.747 0.819 . . . . 74.209999999999994 108.99 172.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.57 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 25.5 m -100.79 105.52 16.83 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.868 -0.79 . . . . 61.340000000000003 108.868 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 29' ' ' ALA . 33.4 mm -88.26 124.97 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 108.787 -0.819 . . . . 73.129999999999995 108.787 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -110.31 123.77 50.44 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.193 -1.04 . . . . 71.219999999999999 108.193 177.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.456 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -117.52 178.33 4.43 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.051 0.54 . . . . 75.450000000000003 110.67 -173.199 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.402 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 23.2 t70 -92.33 155.41 17.94 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.536 0.734 . . . . 72.299999999999997 110.432 173.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -58.26 -35.43 71.74 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.603 1.161 . . . . 71.219999999999999 113.635 -173.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 79.3 mtp -76.69 -21.38 55.45 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.847 0.459 . . . . 71.329999999999998 111.85 -175.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.506 HG11 ' HA3' ' A' ' 73' ' ' GLY . 10.9 t -103.21 121.08 54.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 108.824 -0.806 . . . . 74.439999999999998 108.824 -173.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -101.61 150.88 22.64 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.042 0.937 . . . . 75.150000000000006 109.271 -171.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.456 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 85.6 m95 -59.52 -15.71 19.77 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.893 1.071 . . . . 75.5 113.893 -172.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -58.61 -39.24 79.88 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.698 0.799 . . . . 72.329999999999998 111.692 176.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.3 t -91.29 -12.99 33.48 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.666 0.787 . . . . 74.420000000000002 111.32 -176.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.485 HG12 ' SG ' ' A' ' 71' ' ' CYS . 59.6 mt -103.27 -54.79 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 C-N-CA 123.769 0.828 . . . . 74.019999999999996 111.253 -168.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -54.34 -54.19 50.96 Favored Pre-proline 0 CA--C 1.566 1.596 0 C-N-CA 124.78 1.232 . . . . 63.329999999999998 113.494 -171.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.29 -36.12 80.98 Favored 'Trans proline' 0 C--N 1.401 3.318 0 C-N-CA 122.237 1.958 . . . . 74.150000000000006 112.237 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 15.6 mm-40 -62.65 -48.66 78.38 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.579 -0.737 . . . . 72.239999999999995 110.085 178.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.413 ' O ' HD13 ' A' ' 105' ' ' LEU . 50.9 mt -67.29 -41.79 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 123.395 0.678 . . . . 73.109999999999999 111.755 -177.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.521 HG23 ' HB ' ' A' ' 19' ' ' ILE . 57.9 mt -56.82 -41.25 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 123.112 0.565 . . . . 73.120000000000005 110.854 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -57.18 -52.13 66.54 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.46 0.704 . . . . 73.450000000000003 110.609 174.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.494 HD22 ' HB3' ' A' ' 66' ' ' GLN . 61.8 mt -64.04 -36.13 82.98 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.353 1.061 . . . . 54.210000000000001 112.316 -174.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.641 HD12 HD11 ' A' ' 63' ' ' LEU . 9.2 mp -69.88 -29.48 66.7 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.642 0.777 . . . . 53.539999999999999 111.028 177.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 50.3 m -78.14 -41.51 34.72 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.953 -0.758 . . . . 34.420000000000002 108.953 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -58.32 -56.86 16.57 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.337 1.055 . . . . 71.140000000000001 111.218 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.493 ' OE1' ' HB2' ' A' ' 63' ' ' LEU . 28.9 tt0 -58.04 -50.32 73.83 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.72 0.808 . . . . 71.030000000000001 111.585 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.403 ' HB2' HG13 ' A' ' 17' ' ' ILE . 82.4 mt -77.58 -18.07 57.23 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 115.049 -0.978 . . . . 64.120000000000005 111.639 -175.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.36 -42.57 71.64 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 122.746 0.419 . . . . 62.439999999999998 110.401 173.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -72.9 -19.33 61.29 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.858 -0.61 . . . . 74.319999999999993 110.361 172.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.81 59.58 2.77 Favored Glycine 0 C--N 1.344 1.022 0 CA-C-N 115.729 -0.669 . . . . 32.130000000000003 112.413 173.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -137.12 157.27 47.07 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 123.12 0.568 . . . . 73.200000000000003 110.119 177.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -80.68 160.46 24.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.803 1.241 . . . . 73.430000000000007 110.177 177.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.78 HG11 HG21 ' A' ' 79' ' ' ILE . 2.1 p . . . . . 0 N--CA 1.479 0.991 0 C-N-CA 124.521 1.129 . . . . 75.340000000000003 112.478 178.304 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.415 ' HB ' HG23 ' A' ' 106' ' ' THR . 72.9 mt . . . . . 0 N--CA 1.471 0.605 0 CA-C-O 120.503 0.192 . . . . 71.409999999999997 110.816 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.88 121.93 16.17 Favored 'General case' 0 C--O 1.242 0.666 0 O-C-N 123.902 0.751 . . . . 73.200000000000003 109.982 172.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 47.6 mm -127.16 116.59 44.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 105.915 -1.883 . . . . 73.420000000000002 105.915 172.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -101.69 151.75 21.66 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.83 -1.174 . . . . 71.040000000000006 107.83 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.8 m -122.7 112.61 18.15 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.202 -0.666 . . . . 74.129999999999995 109.202 175.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.7 mt -86.72 139.46 30.72 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.701 0.8 . . . . 42.539999999999999 110.086 176.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -78.77 144.7 34.91 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.525 0.73 . . . . 73.430000000000007 109.344 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.9 p -122.98 162.68 37.8 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 124.332 1.053 . . . . 74.230000000000004 109.667 -174.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -75.81 43.77 1.16 Allowed 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 123.008 2.472 . . . . 74.329999999999998 112.448 171.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -155.79 138.47 15.15 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.763 -0.829 . . . . 70.450000000000003 108.763 -176.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -81.39 -43.12 19.44 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.545 0.738 . . . . 63.140000000000001 110.876 178.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -67.53 -45.42 75.79 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.894 0.877 . . . . 71.109999999999999 110.31 -178.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.55 132.19 35.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.41 0.684 . . . . 54.210000000000001 110.907 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 tp -135.49 128.9 32.26 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 108.382 -0.97 . . . . 73.340000000000003 108.382 172.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -93.11 118.2 30.94 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.437 0.695 . . . . 63.439999999999998 111.5 -171.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -103.39 116.69 32.9 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.306 1.042 . . . . 61.310000000000002 108.25 172.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.7 tp -104.18 127.65 51.81 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.639 0.776 . . . . 71.129999999999995 110.088 -178.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.4 t -83.69 115.95 22.42 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.749 -0.834 . . . . 71.209999999999994 108.749 174.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 71.4 p -107.47 -43.46 4.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 122.825 0.45 . . . . 73.329999999999998 112.02 -171.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -102.1 -24.95 13.89 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 112.575 0.583 . . . . 75.329999999999998 112.575 -174.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . 0.403 ' HA3' HD13 ' A' ' 109' ' ' LEU . . . -81.75 -140.51 3.18 Favored Glycine 0 C--N 1.34 0.795 0 C-N-CA 121.603 -0.332 . . . . 74.120000000000005 112.504 -175.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.515 ' HB2' HD22 ' A' ' 109' ' ' LEU . 41.0 mt-10 -99.24 -171.67 2.12 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.398 0.679 . . . . 62.409999999999997 109.763 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 13.9 ttt -106.93 143.37 35.13 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.364 -0.976 . . . . 73.040000000000006 108.364 177.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -75.02 -56.61 4.56 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.561 0.744 . . . . 73.540000000000006 111.371 -174.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.472 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.7 tp-100 . . . . . 0 N--CA 1.485 1.316 0 C-N-CA 124.378 1.071 . . . . 73.129999999999995 109.127 -173.603 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.7 t . . . . . 0 N--CA 1.477 0.899 0 N-CA-C 109.329 -0.619 . . . . 75.540000000000006 109.329 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -77.02 127.87 33.47 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 109.585 -0.524 . . . . 74.340000000000003 109.585 174.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.0 p -65.25 119.59 11.18 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.042 0.937 . . . . 72.230000000000004 111.502 -179.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.0 mp -79.97 109.7 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.132 0.973 . . . . 70.430000000000007 109.028 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 96.4 t -91.94 114.81 29.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 108.664 -0.865 . . . . 53.439999999999998 108.664 178.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 70.4 mt -110.19 111.2 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 108.373 -0.973 . . . . 55.030000000000001 108.373 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -89.15 172.53 9.02 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 120.975 0.417 . . . . 74.150000000000006 110.25 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -65.24 -23.35 67.04 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.649 0.78 . . . . 73.319999999999993 110.935 170.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.2 p -79.45 -25.18 42.02 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.913 0.885 . . . . 60.219999999999999 111.145 175.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.409 ' O ' HG13 ' A' ' 58' ' ' ILE . 15.9 m-20 -83.86 55.91 3.46 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.643 0.777 . . . . 54.520000000000003 110.264 176.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -56.28 -35.79 67.88 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.81 0.844 . . . . 75.129999999999995 111.37 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.85 -42.67 84.92 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.123 0.969 . . . . 71.439999999999998 110.924 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.9 mt -79.13 -29.38 43.14 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.717 -0.674 . . . . 72.349999999999994 111.022 -178.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 54' ' ' ASP . 76.2 mt -63.36 -50.98 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 123.228 0.611 . . . . 62.509999999999998 109.557 175.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -59.9 -32.14 70.46 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.294 0.638 . . . . 52.130000000000003 110.572 176.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 5.9 t60 -78.34 -15.45 58.7 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 122.725 0.41 . . . . 73.530000000000001 111.68 -177.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 56.8 p -124.39 113.86 18.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.71 0.404 . . . . 74.150000000000006 110.881 -178.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -53.51 -47.43 69.9 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.138 1.375 . . . . 74.109999999999999 112.105 -176.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.46 ' HB2' ' OE1' ' A' ' 108' ' ' GLN . 24.9 tp -62.01 -39.99 94.15 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.143 -0.935 . . . . 73.120000000000005 111.97 -176.22 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.36 -45.58 93.0 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.245 0.618 . . . . 35.340000000000003 111.406 -177.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -54.69 -46.14 74.06 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.515 1.134 . . . . 72.040000000000006 110.863 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.418 ' HB3' HD22 ' A' ' 104' ' ' LEU . 18.3 mm100 -63.52 -45.54 90.15 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.108 0.963 . . . . 61.509999999999998 112.137 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.8 mt -65.11 -47.51 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.119 0.568 . . . . 75.409999999999997 111.171 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -65.65 -31.84 73.09 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.305 0.642 . . . . 64.409999999999997 111.501 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.34 -57.3 7.77 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.287 0.635 . . . . 55.409999999999997 111.063 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -72.2 -29.16 63.71 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.836 -0.62 . . . . 74.129999999999995 111.546 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.548 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 63.6 m -137.73 88.58 16.09 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 108.938 -0.764 . . . . 71.209999999999994 108.938 -179.161 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.79 -3.89 12.95 Favored 'Trans proline' 0 C--N 1.379 2.156 0 C-N-CA 123.052 2.501 . . . . 62.109999999999999 113.676 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.71 -15.72 80.96 Favored Glycine 0 C--N 1.352 1.418 0 O-C-N 123.196 0.31 . . . . 63.329999999999998 112.851 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.511 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 95.7 t -67.23 122.27 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 123.372 0.669 . . . . 52.219999999999999 109.649 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -83.31 -44.93 14.36 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.807 0.843 . . . . 74.109999999999999 110.739 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 61.5 p -155.01 170.92 20.65 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.511 0.672 . . . . 63.299999999999997 111.22 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 78.8 mt -129.97 156.72 43.98 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.93 1.292 . . . . 62.229999999999997 108.661 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.562 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 50.8 ttm -130.09 100.54 5.46 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.303 -1.369 . . . . 70.329999999999998 107.303 170.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.479 HD12 HG21 ' A' ' 115' ' ' VAL . 40.7 mm -74.67 107.73 5.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 107.547 -1.279 . . . . 73.450000000000003 107.547 176.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.66 -117.09 0.28 Allowed Glycine 0 C--N 1.34 0.777 0 N-CA-C 110.063 -1.215 . . . . 64.030000000000001 110.063 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.472 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 1.6 p-10 -149.32 -57.68 0.2 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.093 0.557 . . . . 75.040000000000006 109.657 171.174 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -83.69 -29.58 27.46 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.864 0.466 . . . . 65.430000000000007 109.791 170.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -116.47 170.3 8.67 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.982 0.913 . . . . 73.310000000000002 110.814 -174.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 46.0 tp -135.12 146.05 48.45 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.313 1.445 . . . . 72.230000000000004 107.471 171.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.562 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 35.5 m -127.71 130.18 48.4 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 109.132 -0.692 . . . . 73.340000000000003 109.132 175.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.1 mm -108.16 128.51 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 108.894 -0.78 . . . . 75.510000000000005 108.894 -178.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -109.11 107.2 17.42 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 108.882 -0.784 . . . . 73.120000000000005 108.882 178.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -106.6 163.59 12.76 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.216 0.606 . . . . 75.120000000000005 109.716 -178.821 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.65 145.23 38.95 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 122.635 0.374 . . . . 72.439999999999998 110.282 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -58.89 -34.94 72.22 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.181 0.992 . . . . 74.150000000000006 112.869 -173.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.8 mmm -70.85 -26.02 63.08 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.124 0.57 . . . . 73.230000000000004 110.559 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.5 t -91.77 142.3 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.044 -1.095 . . . . 65.519999999999996 108.044 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -109.03 146.2 34.32 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.944 0.498 . . . . 73.129999999999995 111.116 -174.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . 0.494 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 80.4 m95 -63.14 -13.54 38.0 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.054 0.941 . . . . 63.210000000000001 112.809 178.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -52.56 -39.71 61.78 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.173 0.989 . . . . 74.219999999999999 112.079 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 40.5 m -103.42 -0.53 29.88 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.366 0.667 . . . . 52.450000000000003 112.211 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.548 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 57.2 mt -109.49 -50.83 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 123.322 0.649 . . . . 61.149999999999999 111.275 -171.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.0 ttpm? -55.94 -51.74 78.08 Favored Pre-proline 0 CA--C 1.561 1.398 0 CA-C-O 117.778 -1.106 . . . . 74.510000000000005 113.28 -170.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.02 -33.65 91.74 Favored 'Trans proline' 0 C--N 1.4 3.266 0 C-N-CA 121.799 1.666 . . . . 34.43 112.157 -177.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 8.0 mm-40 -65.36 -47.51 76.17 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 115.513 -0.767 . . . . 75.409999999999997 110.24 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.1 mt -70.64 -37.97 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.042 0.537 . . . . 74.299999999999997 111.497 -177.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 97.9 mt -54.79 -44.37 71.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 N-CA-C 109.732 -0.47 . . . . 45.539999999999999 109.732 173.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 32.5 t70 -67.19 -40.74 86.55 Favored 'General case' 0 C--N 1.351 0.671 0 CA-C-N 115.039 -0.982 . . . . 72.420000000000002 111.181 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 95.9 mt -61.86 -39.96 93.68 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.803 0.841 . . . . 74.310000000000002 111.96 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.451 HD12 HD11 ' A' ' 63' ' ' LEU . 10.9 mp -71.06 -21.26 62.27 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.597 -0.729 . . . . 74.530000000000001 110.628 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.415 HG23 ' HB ' ' A' ' 17' ' ' ILE . 24.0 m -81.73 -37.88 26.6 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.985 -0.746 . . . . 74.109999999999999 108.985 174.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 103' ' ' ASP . 11.0 mmpt? -59.33 -62.57 1.78 Allowed 'General case' 0 C--N 1.368 1.388 0 C-N-CA 124.041 0.936 . . . . 73.400000000000006 110.924 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.46 ' OE1' ' HB2' ' A' ' 63' ' ' LEU . 25.9 tt0 -55.41 -47.13 76.39 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 124.658 1.224 . . . . 71.310000000000002 111.652 -171.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 38' ' ' GLU . 82.7 mt -70.83 -30.62 67.09 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 115.459 -0.791 . . . . 73.349999999999994 111.128 -178.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.39 -26.91 61.19 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.016 0.526 . . . . 73.049999999999997 111.348 176.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -72.77 -27.05 61.78 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.762 0.425 . . . . 71.329999999999998 110.148 170.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 91.59 36.02 6.67 Favored Glycine 0 C--N 1.346 1.117 0 N-CA-C 111.543 -0.623 . . . . 60.140000000000001 111.543 -177.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -120.54 159.57 24.94 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.155 0.982 . . . . 72.420000000000002 111.203 -173.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.9 174.02 6.06 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.338 1.055 . . . . 70.099999999999994 109.093 172.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.479 HG21 HD12 ' A' ' 79' ' ' ILE . 1.9 p . . . . . 0 CA--C 1.55 0.974 0 N-CA-C 112.909 0.707 . . . . 72.219999999999999 112.909 -171.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.451 HG21 HD12 ' A' ' 109' ' ' LEU . 59.2 mt . . . . . 0 C--O 1.237 0.407 0 N-CA-C 110.313 -0.255 . . . . 74.430000000000007 110.313 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -62.86 99.73 0.17 Allowed 'General case' 0 CA--C 1.548 0.884 0 O-C-N 124.032 0.833 . . . . 71.439999999999998 111.042 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.0 mm -119.66 107.0 20.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 106.044 -1.836 . . . . 70.340000000000003 106.044 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -99.36 127.57 45.4 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.392 -0.595 . . . . 71.209999999999994 109.392 -172.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.5 t -91.08 126.55 36.2 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-O 121.527 0.68 . . . . 63.229999999999997 109.635 -176.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.474 HD11 HD22 ' A' ' 33' ' ' LEU . 84.3 mt -123.58 138.08 54.62 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 124.566 1.146 . . . . 71.109999999999999 108.834 -176.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 62.3 p -74.73 147.95 40.9 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.539 -0.755 . . . . 74.140000000000001 110.621 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.7 p -117.31 162.97 25.49 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 123.977 0.911 . . . . 72.510000000000005 109.922 -176.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.83 -13.19 37.99 Favored 'Trans proline' 0 C--N 1.383 2.347 0 C-N-CA 122.6 2.2 . . . . 64.319999999999993 113.094 172.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -98.88 131.51 44.91 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.438 0.695 . . . . 74.430000000000007 109.208 175.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.8 -30.94 70.48 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.142 0.577 . . . . 65.319999999999993 111.164 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 26.8 p-10 -95.23 2.32 54.87 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.521 0.728 . . . . 74.140000000000001 112.401 -174.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -111.27 156.58 21.27 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.035 0.534 . . . . 60.020000000000003 110.188 174.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.7 tp -149.38 120.19 7.59 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 108.813 -0.81 . . . . 64.129999999999995 108.813 175.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -82.43 117.94 22.84 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.849 0.86 . . . . 71.120000000000005 110.194 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -100.26 119.34 38.24 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 107.73 -1.211 . . . . 74.010000000000005 107.73 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.474 HD22 HD11 ' A' ' 22' ' ' LEU . 27.3 tp -102.2 125.59 48.94 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.706 -0.85 . . . . 72.510000000000005 108.706 -172.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.5 m -85.61 105.87 16.5 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.206 -1.405 . . . . 61.25 107.206 175.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.9 p -94.05 101.11 13.13 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.533 0.733 . . . . 72.120000000000005 109.314 -178.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.4 t70 62.26 74.87 0.42 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.758 1.223 . . . . 72.310000000000002 111.033 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -151.85 -127.94 1.37 Allowed Glycine 0 C--N 1.342 0.865 0 CA-C-N 115.033 -0.985 . . . . 64.400000000000006 111.64 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.535 ' HB2' HD22 ' A' ' 109' ' ' LEU . 56.6 mm-40 -98.06 151.73 20.04 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 117.718 0.759 . . . . 73.140000000000001 111.269 178.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 12.0 tpt -88.04 99.75 12.41 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.146 -0.934 . . . . 75.510000000000005 108.902 177.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.04 -51.18 63.03 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.685 0.794 . . . . 44.140000000000001 111.986 -170.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.485 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.7 tp-100 . . . . . 0 N--CA 1.474 0.771 0 N-CA-C 108.819 -0.808 . . . . 74.219999999999999 108.819 173.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.6 t . . . . . 0 CA--C 1.541 0.632 0 N-CA-C 107.984 -1.117 . . . . 62.32 107.984 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -61.2 146.22 48.46 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.398 0.679 . . . . 62.32 111.559 -178.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.5 p -69.68 97.74 1.1 Allowed 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 109.102 -0.703 . . . . 61.049999999999997 109.102 173.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 72.8 mt -72.44 109.49 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 115.709 -0.678 . . . . 61.420000000000002 110.366 -170.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.5 t -85.4 106.59 15.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 107.906 -1.146 . . . . 64.450000000000003 107.906 176.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.473 HG12 ' HB3' ' A' ' 57' ' ' LEU . 59.1 mt -96.33 109.65 23.24 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.349 0 N-CA-C 107.498 -1.297 . . . . 75.120000000000005 107.498 -177.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -92.4 160.18 15.22 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 117.737 0.244 . . . . 73.430000000000007 110.385 -178.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -66.76 -21.59 66.05 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.817 0.447 . . . . 64.310000000000002 111.382 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 10.0 t -93.06 -23.78 18.53 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.861 0.864 . . . . 51.119999999999997 110.536 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.14 69.82 10.52 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.235 -0.654 . . . . 63.140000000000001 109.235 174.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -64.2 -24.61 67.74 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.982 -1.008 . . . . 72.349999999999994 110.831 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -59.74 -36.83 77.4 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.95 0.9 . . . . 71.109999999999999 110.835 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.473 ' HB3' HG12 ' A' ' 50' ' ' ILE . 88.1 mt -82.9 -28.68 29.81 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.567 0.747 . . . . 62.130000000000003 111.517 176.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.472 HG22 ' HG2' ' A' ' 65' ' ' GLN . 61.7 mt -65.09 -40.14 87.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.45 0.7 . . . . 52.399999999999999 110.114 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -65.97 -17.11 64.46 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.113 0.565 . . . . 63.509999999999998 112.096 175.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -85.79 6.57 27.42 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.169 0.588 . . . . 61.43 112.31 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 38.2 t -159.74 114.83 2.38 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.247 0.619 . . . . 75.430000000000007 110.512 179.167 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 3.9 tppp? -63.16 -32.7 74.16 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.703 0.401 . . . . 72.450000000000003 110.844 173.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.451 HD11 ' HB3' ' A' ' 104' ' ' LEU . 44.8 tp -63.73 -41.18 98.09 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 122.783 0.433 . . . . 71.430000000000007 110.367 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.61 -44.57 96.16 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 123.16 0.584 . . . . 73.209999999999994 110.324 177.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.472 ' HG2' HG22 ' A' ' 58' ' ' ILE . 76.2 mt-30 -55.5 -42.93 75.12 Favored 'General case' 0 C--N 1.351 0.66 0 O-C-N 124.497 1.123 . . . . 72.439999999999998 110.973 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 14.6 mm100 -69.73 -38.29 76.81 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.124 0.569 . . . . 73.25 112.427 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . 0.453 HG22 HG21 ' A' ' 74' ' ' VAL . 81.8 mt -68.32 -48.16 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 122.716 0.406 . . . . 61.409999999999997 110.473 -178.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -65.19 -32.3 73.91 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.754 -0.657 . . . . 70.25 111.391 177.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.5 tp -67.66 -56.38 9.58 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.236 0.614 . . . . 71.510000000000005 110.692 177.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -59.41 -34.04 71.96 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.738 0.815 . . . . 43.420000000000002 112.015 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.528 ' SG ' HG23 ' A' ' 97' ' ' ILE . 63.8 m -137.05 114.89 10.02 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 110.183 -0.303 . . . . 52.439999999999998 110.183 -176.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -71.72 -11.04 27.45 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.327 2.018 . . . . 70.430000000000007 111.849 171.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -88.04 18.65 39.01 Favored Glycine 0 C--N 1.355 1.601 0 CA-C-O 119.79 -0.45 . . . . 74.319999999999993 113.277 -177.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.631 HG22 ' NZ ' ' A' ' 88' ' ' LYS . 15.1 t -97.54 124.79 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 108.794 -0.817 . . . . 75.430000000000007 108.794 172.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -84.2 -52.21 6.43 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.656 0.382 . . . . 61.409999999999997 110.297 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 97.1 p -156.18 172.31 18.67 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 112.057 0.391 . . . . 62.409999999999997 112.057 -177.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 34.5 mt -131.47 126.03 33.98 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 108.226 -1.027 . . . . 74.299999999999997 108.226 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.486 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.3 ttm -100.92 111.56 23.8 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.775 -0.824 . . . . 73.430000000000007 108.775 178.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.616 HD13 HD13 ' A' ' 84' ' ' LEU . 20.9 mm -86.16 98.05 6.48 Favored 'Isoleucine or valine' 0 C--N 1.349 0.564 0 N-CA-C 108.82 -0.807 . . . . 71.340000000000003 108.82 -177.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.06 176.27 42.15 Favored Glycine 0 C--O 1.243 0.715 0 N-CA-C 111.174 -0.77 . . . . 50.399999999999999 111.174 176.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.485 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 31.1 m-20 -51.48 -59.74 3.92 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.265 1.026 . . . . 74.099999999999994 111.611 -176.216 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -128.5 22.46 5.97 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.153 -1.385 . . . . 74.439999999999998 110.016 -174.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . 0.441 ' HB3' HD12 ' A' ' 33' ' ' LEU . 37.0 p90 -149.12 154.94 39.95 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 122.895 0.478 . . . . 74.540000000000006 110.789 -175.162 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.616 HD13 HD13 ' A' ' 79' ' ' ILE . 27.5 tp -131.34 110.95 11.44 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 108.082 -1.081 . . . . 70.129999999999995 108.082 176.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 41.7 m -100.01 109.73 22.05 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 108.48 -0.934 . . . . 51.420000000000002 108.48 -176.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.547 HG13 HD13 ' A' ' 101' ' ' ILE . 20.9 mm -86.38 131.71 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 N-CA-C 108.012 -1.107 . . . . 72.019999999999996 108.012 -175.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -112.0 124.44 52.4 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.017 -1.105 . . . . 71.219999999999999 108.017 178.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.631 ' NZ ' HG22 ' A' ' 74' ' ' VAL . 69.1 mttm -129.12 177.39 7.18 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.318 1.047 . . . . 73.549999999999997 109.475 -178.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.11 139.37 58.76 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.49 0.494 . . . . 72.299999999999997 109.956 168.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -62.1 -27.52 68.98 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.661 0.784 . . . . 61.420000000000002 112.571 -174.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 26.4 mmt -87.38 -16.72 34.14 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.584 0.354 . . . . 74.010000000000005 111.659 -178.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 72.6 t -75.57 133.76 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.395 -0.965 . . . . 63.049999999999997 108.395 173.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 65.5 m170 -104.53 148.88 25.99 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.25 0.548 . . . . 72.140000000000001 110.33 -176.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -76.94 -19.13 57.74 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.134 0.974 . . . . 75.239999999999995 112.262 -173.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -57.7 -26.95 62.45 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.901 0.48 . . . . 74.549999999999997 111.667 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -82.81 -52.49 6.69 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 122.961 0.505 . . . . 75.439999999999998 111.989 177.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.528 HG23 ' SG ' ' A' ' 71' ' ' CYS . 26.8 mt -93.94 -33.46 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 113.133 0.79 . . . . 55.409999999999997 113.133 -164.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -49.43 -46.74 78.16 Favored Pre-proline 0 CA--C 1.568 1.667 0 CA-C-O 117.564 -1.207 . . . . 70.019999999999996 113.784 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -56.0 -35.59 94.76 Favored 'Trans proline' 0 C--N 1.396 3.029 0 CA-C-N 121.626 1.616 . . . . 60.420000000000002 112.844 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -73.16 -34.83 66.27 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.207 0.603 . . . . 51.509999999999998 110.595 -179.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.547 HD13 HG13 ' A' ' 86' ' ' ILE . 84.0 mt -68.5 -49.06 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.481 0.712 . . . . 75.319999999999993 109.921 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 87.1 mt -58.23 -38.07 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.594 0.758 . . . . 74.200000000000003 110.301 177.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . 0.401 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 13.6 t70 -61.98 -51.53 67.69 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.829 0.852 . . . . 73.420000000000002 110.923 176.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.451 ' HB3' HD11 ' A' ' 63' ' ' LEU . 69.7 mt -62.9 -39.38 94.33 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.09 0.956 . . . . 55.229999999999997 111.92 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.491 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 8.5 mp -70.42 -28.55 65.14 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.398 0.679 . . . . 62.43 110.5 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 94.8 m -69.58 -37.06 76.82 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 109.111 -0.699 . . . . 74.109999999999999 109.111 174.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' A' ' 103' ' ' ASP . 45.3 mmtm -67.9 -44.95 75.76 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.053 0.541 . . . . 72.129999999999995 110.328 178.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -58.23 -47.23 84.18 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.447 1.099 . . . . 75.549999999999997 111.017 -178.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 38' ' ' GLU . 18.0 mt -76.4 -26.55 55.7 Favored 'General case' 0 CA--C 1.553 1.08 0 CA-C-N 115.821 -0.627 . . . . 73.299999999999997 110.708 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.26 -21.88 60.52 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.042 0.537 . . . . 74.109999999999999 111.69 178.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -69.4 -24.81 63.9 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 110.133 -0.321 . . . . 44.329999999999998 110.133 170.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 71.76 38.52 60.82 Favored Glycine 0 C--N 1.347 1.161 0 N-CA-C 111.079 -0.808 . . . . 63.119999999999997 111.079 -174.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -135.59 160.4 38.62 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 124.11 0.964 . . . . 71.310000000000002 111.643 -173.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -78.93 152.59 31.01 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 114.404 -1.271 . . . . 63.240000000000002 109.293 177.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 7.8 p . . . . . 0 N--CA 1.484 1.253 0 C-N-CA 122.839 0.456 . . . . 73.540000000000006 110.535 178.489 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 64.5 mt . . . . . 0 N--CA 1.469 0.498 0 N-CA-C 109.304 -0.628 . . . . 71.230000000000004 109.304 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -71.89 136.18 46.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.521 -0.763 . . . . 74.510000000000005 109.229 -176.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 48.9 mm -118.55 143.32 29.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 N-CA-C 107.9 -1.148 . . . . 64.329999999999998 107.9 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HD2' HD23 ' A' ' 33' ' ' LEU . 40.4 ttmt -91.49 114.97 27.64 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.421 -0.585 . . . . 64.219999999999999 109.421 -177.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 97.6 m -95.05 120.88 36.01 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 108.93 -0.767 . . . . 74.540000000000006 108.93 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.6 mt -125.23 141.91 51.81 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.333 1.053 . . . . 72.430000000000007 109.536 -174.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.6 p -73.97 143.37 45.67 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.143 0.577 . . . . 72.239999999999995 110.44 174.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.3 p -111.95 160.89 28.19 Favored Pre-proline 0 N--CA 1.478 0.947 0 C-N-CA 124.245 1.018 . . . . 72.209999999999994 109.401 -178.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -79.29 30.85 0.47 Allowed 'Trans proline' 0 C--N 1.375 1.95 0 C-N-CA 123.192 2.595 . . . . 71.140000000000001 112.855 172.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -142.28 127.43 18.57 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.398 -0.964 . . . . 64.439999999999998 108.398 -177.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -73.2 158.22 35.66 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.382 -0.599 . . . . 63.119999999999997 109.382 173.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 70.49 -6.46 1.19 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.113 1.365 . . . . 72.319999999999993 111.68 -173.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.42 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -117.57 145.51 44.23 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 124.101 0.961 . . . . 63.5 109.758 -172.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.6 tp -153.2 129.69 10.67 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 108.864 -0.791 . . . . 75.540000000000006 108.864 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -82.82 131.53 35.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.754 0.821 . . . . 63.5 111.127 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -122.19 114.37 20.76 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.977 -1.49 . . . . 73.209999999999994 106.977 172.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.46 HD23 ' HD2' ' A' ' 20' ' ' LYS . 52.7 tp -113.86 127.92 56.19 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 123.983 0.913 . . . . 61.219999999999999 110.269 -165.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 m -90.29 103.73 16.38 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.156 -1.053 . . . . 63.32 108.156 177.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 73.5 p -102.34 -11.45 18.66 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.966 0.907 . . . . 64.120000000000005 111.578 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -62.88 -44.93 94.79 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.943 0.897 . . . . 73.430000000000007 111.875 -177.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 150.83 -32.4 0.98 Allowed Glycine 0 C--N 1.346 1.108 0 CA-C-N 116.277 -0.42 . . . . 53.32 113.184 178.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -69.98 106.66 3.28 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.036 0.446 . . . . 51.030000000000001 109.829 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.5 tpt -85.2 133.97 34.17 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.319 1.048 . . . . 62.420000000000002 109.865 -171.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.415 ' O ' HG12 ' A' ' 115' ' ' VAL . 73.5 mt -70.46 -35.59 73.41 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.473 0.709 . . . . 73.409999999999997 112.756 -172.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 . . . . . 0 N--CA 1.48 1.063 0 N-CA-C 107.874 -1.158 . . . . 72.200000000000003 107.874 172.317 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.57 ' HB3' ' HB3' ' A' ' 81' ' ' ASP . 35.1 t . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 121.117 0.484 . . . . 73.109999999999999 110.908 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -81.22 154.28 26.73 Favored 'General case' 0 C--O 1.246 0.892 0 C-N-CA 123.932 0.893 . . . . 72.439999999999998 110.116 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.0 p -79.39 91.47 5.09 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.902 0.481 . . . . 72.230000000000004 109.825 176.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.3 mt -75.77 116.69 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.018 0.927 . . . . 75.310000000000002 109.866 -176.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.5 t -90.88 119.28 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 108.579 -0.897 . . . . 72.340000000000003 108.579 178.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.411 HG23 ' HB2' ' A' ' 57' ' ' LEU . 61.3 mt -117.11 110.65 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 107.775 -1.194 . . . . 70.150000000000006 107.775 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.402 ' HG2' ' HB2' ' A' ' 76' ' ' SER . 10.2 mtmp? -93.29 172.58 8.2 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 109.595 -0.52 . . . . 74.150000000000006 109.595 177.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.9 p30 -64.7 -21.15 66.68 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.212 0.605 . . . . 70.150000000000006 112.345 -177.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.5 t -83.92 -21.18 31.95 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 122.507 0.323 . . . . 74.230000000000004 110.717 176.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -83.23 56.33 3.49 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.999 0.92 . . . . 73.420000000000002 110.296 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.425 ' HA ' HD12 ' A' ' 58' ' ' ILE . 34.5 tt0 -63.73 -25.72 68.32 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.457 0.703 . . . . 63.219999999999999 111.667 -175.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.18 -45.51 93.08 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.79 0.836 . . . . 72.319999999999993 110.281 173.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.45 ' HA ' ' HD2' ' A' ' 60' ' ' HIS . 87.0 mt -73.29 -30.03 63.13 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 115.703 -0.681 . . . . 71.219999999999999 111.106 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 55' ' ' GLU . 75.5 mt -65.28 -39.06 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.203 0.601 . . . . 73.030000000000001 109.427 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -70.68 -10.85 60.34 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 112.965 0.728 . . . . 73.040000000000006 112.965 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.45 ' HD2' ' HA ' ' A' ' 57' ' ' LEU . 83.2 m-70 -80.79 -34.3 34.19 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.701 0.4 . . . . 54.0 110.619 170.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 39.3 t -108.65 106.78 16.98 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.326 0.65 . . . . 61.43 110.611 -177.545 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -54.77 -37.51 66.09 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.392 0.677 . . . . 72.150000000000006 110.809 173.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.13 -42.55 99.52 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.537 0.735 . . . . 73.549999999999997 111.033 178.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.79 -45.08 93.41 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 122.819 0.448 . . . . 72.409999999999997 109.833 178.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -55.95 -44.38 78.37 Favored 'General case' 0 C--N 1.353 0.734 0 O-C-N 124.065 0.853 . . . . 74.129999999999995 110.812 177.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -62.36 -46.56 88.09 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.69 0.796 . . . . 73.299999999999997 112.069 178.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.9 mt -64.71 -49.83 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 C-N-CA 123.641 0.776 . . . . 61.439999999999998 111.065 -175.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -66.76 -36.19 81.85 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.417 0.687 . . . . 64.430000000000007 111.502 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.9 tp -64.99 -46.6 80.76 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.444 0.698 . . . . 73.329999999999998 110.835 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.493 ' NE2' HD21 ' A' ' 104' ' ' LEU . 75.3 mt-30 -73.21 -28.92 62.45 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.123 -0.944 . . . . 63.299999999999997 111.642 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.439 ' SG ' HD13 ' A' ' 97' ' ' ILE . 42.9 t -149.08 104.16 3.36 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 122.47 0.308 . . . . 64.120000000000005 110.783 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -78.08 14.55 1.51 Allowed 'Trans proline' 0 C--N 1.373 1.816 0 C-N-CA 122.738 2.292 . . . . 43.450000000000003 112.745 171.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -85.77 -18.42 59.9 Favored Glycine 0 C--N 1.35 1.322 0 N-CA-C 111.764 -0.535 . . . . 75.030000000000001 111.764 170.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.424 ' HA ' ' HB3' ' A' ' 88' ' ' LYS . 87.7 t -70.74 114.59 8.89 Favored 'Isoleucine or valine' 0 C--N 1.351 0.669 0 N-CA-C 109.228 -0.656 . . . . 70.239999999999995 109.228 175.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -86.02 -32.95 21.19 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.264 0.626 . . . . 72.510000000000005 110.678 -174.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . 0.402 ' HB2' ' HG2' ' A' ' 51' ' ' LYS . 33.4 t -161.45 167.14 26.13 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 121.345 0.593 . . . . 54.0 111.319 -175.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 76.7 mt -134.4 128.61 33.92 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.721 1.208 . . . . 71.0 107.928 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.48 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 54.1 ttm -96.21 108.18 20.61 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 107.371 -1.344 . . . . 71.120000000000005 107.371 168.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 20.1 mm -91.33 105.38 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.437 0.695 . . . . 71.400000000000006 109.146 -174.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.87 163.29 24.5 Favored Glycine 0 C--O 1.242 0.636 0 N-CA-C 109.657 -1.377 . . . . 61.520000000000003 109.657 173.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . 0.57 ' HB3' ' HB3' ' A' ' 45' ' ' SER . 19.3 p-10 -74.08 -34.92 64.18 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 122.885 0.474 . . . . 71.319999999999993 110.595 175.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -99.55 -32.86 10.89 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.933 0.893 . . . . 73.040000000000006 111.259 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -131.28 169.28 16.19 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.276 0.63 . . . . 73.549999999999997 111.739 -170.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 54.2 tp -141.12 109.94 6.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.625 0.77 . . . . 63.350000000000001 109.619 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.48 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 59.8 m -100.79 111.57 23.82 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.713 -0.847 . . . . 41.039999999999999 108.713 -178.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.532 HG13 HD13 ' A' ' 101' ' ' ILE . 27.2 mm -86.99 126.22 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.487 -0.931 . . . . 55.450000000000003 108.487 -176.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -108.52 124.63 50.75 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.355 -0.98 . . . . 55.219999999999999 108.355 176.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 74' ' ' VAL . 0.6 OUTLIER -150.2 152.96 35.45 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.228 1.011 . . . . 71.439999999999998 109.154 -177.042 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -60.57 132.32 53.54 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.203 0.601 . . . . 65.219999999999999 110.427 -172.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -62.39 -23.4 66.81 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.633 1.173 . . . . 74.120000000000005 112.493 -175.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.2 mmt -66.21 -30.86 71.39 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.865 0.466 . . . . 75.450000000000003 110.679 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.6 t -92.98 142.83 12.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 N-CA-C 107.151 -1.426 . . . . 64.129999999999995 107.151 172.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -102.72 156.82 17.38 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.34 0.59 . . . . 64.310000000000002 111.579 -176.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -69.02 -17.84 63.96 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 114.629 -1.169 . . . . 54.140000000000001 111.795 179.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -56.01 -31.08 62.75 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.756 0.822 . . . . 74.430000000000007 111.806 -177.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.9 m -92.08 -36.17 13.5 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.382 0.673 . . . . 64.109999999999999 112.034 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.439 HD13 ' SG ' ' A' ' 71' ' ' CYS . 30.4 mt -97.74 -43.15 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 N-CA-C 112.305 0.483 . . . . 71.299999999999997 112.305 -164.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -51.78 -46.15 91.86 Favored Pre-proline 0 N--CA 1.492 1.634 0 CA-C-O 117.76 -1.114 . . . . 73.400000000000006 113.68 -177.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -53.83 -41.88 70.98 Favored 'Trans proline' 0 C--N 1.402 3.361 0 C-N-CA 121.839 1.693 . . . . 73.140000000000001 112.337 173.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -67.66 -39.48 84.56 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.345 -0.843 . . . . 70.349999999999994 110.486 -178.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.532 HD13 HG13 ' A' ' 86' ' ' ILE . 93.7 mt -62.89 -51.54 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.572 0.749 . . . . 72.450000000000003 110.395 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 83.7 mt -59.8 -38.28 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 O-C-N 123.748 0.655 . . . . 65.010000000000005 110.682 -178.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -67.94 -39.31 83.46 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.018 0.927 . . . . 61.030000000000001 111.278 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.493 HD21 ' NE2' ' A' ' 70' ' ' GLN . 77.7 mt -65.72 -39.99 91.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.565 0.746 . . . . 73.109999999999999 111.799 174.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 10.8 mp -68.99 -25.0 64.3 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.032 0.533 . . . . 75.019999999999996 110.36 176.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 88.6 m -71.61 -50.91 26.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 122.984 0.514 . . . . 73.310000000000002 110.038 176.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -65.67 -36.47 83.75 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 123.386 0.429 . . . . 73.519999999999996 110.879 -176.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -59.41 -56.33 23.37 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 122.72 0.408 . . . . 55.329999999999998 110.62 177.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 105' ' ' LEU . 50.2 mt -69.65 -22.47 63.45 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 123.792 0.683 . . . . 74.420000000000002 111.333 -176.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.67 -35.84 70.43 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.567 0.747 . . . . 72.230000000000004 111.888 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -108.26 -13.47 14.89 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 122.952 0.501 . . . . 74.109999999999999 111.474 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -148.7 -159.12 8.35 Favored Glycine 0 C--N 1.345 1.063 0 N-CA-C 112.082 -0.407 . . . . 62.219999999999999 112.082 -175.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -131.85 -60.17 0.93 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.754 0.822 . . . . 72.109999999999999 109.106 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -79.87 171.38 15.19 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.31 -1.314 . . . . 51.200000000000003 111.98 -174.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.415 HG12 ' O ' ' A' ' 40' ' ' LEU . 5.4 p . . . . . 0 CA--C 1.541 0.634 0 CA-C-N 114.085 -1.416 . . . . 74.310000000000002 109.874 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.458 ' HB ' ' HA ' ' A' ' 106' ' ' THR . 69.0 mt . . . . . 0 N--CA 1.467 0.415 0 CA-C-O 120.934 0.397 . . . . 71.239999999999995 110.78 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -83.1 131.13 35.16 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 124.568 1.147 . . . . 75.5 110.47 -175.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . 0.403 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.9 mm -130.17 121.32 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 N-CA-C 108.059 -1.089 . . . . 74.219999999999999 108.059 -175.313 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -90.77 143.34 26.83 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.732 1.213 . . . . 75.230000000000004 110.021 -179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 47.1 m -101.83 120.28 40.12 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 123.43 0.692 . . . . 73.109999999999999 109.727 175.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.8 mt -125.16 138.17 54.15 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.133 0.973 . . . . 72.329999999999998 109.633 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.5 p -86.66 144.46 27.13 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.06 0.544 . . . . 74.209999999999994 110.615 178.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.4 p -108.34 172.78 3.44 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 124.875 1.27 . . . . 75.239999999999995 108.469 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -75.57 50.56 2.72 Favored 'Trans proline' 0 C--N 1.376 2.001 0 C-N-CA 122.13 1.887 . . . . 74.219999999999999 112.372 168.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -162.27 141.14 9.21 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.344 1.058 . . . . 73.540000000000006 108.504 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.29 -31.94 13.86 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.137 0.575 . . . . 62.439999999999998 110.593 -177.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -89.78 7.49 36.65 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.916 0.886 . . . . 74.150000000000006 111.798 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.466 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -136.53 126.17 25.4 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.796 0.838 . . . . 63.219999999999999 109.052 174.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.1 tp -128.42 134.24 48.74 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.461 0.704 . . . . 63.509999999999998 109.177 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -90.87 129.74 36.89 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.479 1.111 . . . . 54.329999999999998 110.538 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -114.7 116.41 28.65 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.717 -1.216 . . . . 75.340000000000003 107.717 171.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.4 tp -100.06 127.32 46.31 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.451 -1.314 . . . . 75.019999999999996 107.451 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.2 t -72.39 107.33 4.91 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 107.254 -1.388 . . . . 73.25 107.254 171.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t -105.64 18.97 21.33 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.474 0.654 . . . . 75.019999999999996 109.73 -179.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -91.32 -55.5 3.49 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.368 0.667 . . . . 64.340000000000003 109.888 177.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 156.65 -17.13 0.41 Allowed Glycine 0 C--N 1.344 1.024 0 CA-C-N 115.908 -0.587 . . . . 31.530000000000001 113.171 -175.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -84.92 105.76 15.93 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.24 0.616 . . . . 62.109999999999999 111.229 -176.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 40.2 ttm -74.97 132.91 41.73 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.502 -0.555 . . . . 75.109999999999999 109.502 175.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.3 mt -62.64 -48.72 78.12 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.826 0.704 . . . . 73.049999999999997 111.342 -177.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 . . . . . 0 CA--C 1.54 0.575 0 CA-C-N 116.182 -0.463 . . . . 73.439999999999998 109.843 -179.662 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m . . . . . 0 N--CA 1.472 0.642 0 CA-C-O 121.018 0.437 . . . . 71.049999999999997 110.79 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -97.3 126.6 42.63 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.755 -1.202 . . . . 73.019999999999996 107.755 170.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.8 m -59.56 121.53 11.8 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.853 0.861 . . . . 75.510000000000005 112.995 -169.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 61.4 mt -87.34 130.89 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.011 0.925 . . . . 72.510000000000005 110.085 -178.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.5 t -97.46 108.64 21.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 N-CA-C 109.263 -0.643 . . . . 75.349999999999994 109.263 178.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 72.1 mt -90.38 110.04 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.549 1.14 . . . . 75.329999999999998 107.961 175.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -84.24 144.36 28.98 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.544 0.738 . . . . 72.430000000000007 110.205 -174.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.4 ' HA ' HD11 ' A' ' 58' ' ' ILE . 31.8 p-10 -65.79 -29.27 69.73 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.086 0.554 . . . . 72.150000000000006 111.321 175.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 t -82.15 -14.38 55.76 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.818 0.847 . . . . 64.140000000000001 111.208 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -102.61 82.46 2.15 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.232 -1.025 . . . . 74.140000000000001 108.232 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . 0.415 ' HA ' HD12 ' A' ' 58' ' ' ILE . 0.1 OUTLIER -57.5 -25.05 59.21 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.117 0.967 . . . . 75.040000000000006 112.519 -178.298 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -65.39 -52.68 51.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.201 0.601 . . . . 74.340000000000003 110.992 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.45 -36.18 77.61 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.951 0.5 . . . . 73.030000000000001 110.39 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.415 HD12 ' HA ' ' A' ' 55' ' ' GLU . 68.8 mt -64.46 -47.12 90.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 115.023 -0.99 . . . . 72.219999999999999 110.522 177.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . 0.433 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 91.2 m-20 -62.12 -32.19 72.73 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.334 0.654 . . . . 75.340000000000003 112.42 -178.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -80.08 -6.47 57.73 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.018 0.527 . . . . 75.310000000000002 112.047 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 23.4 p -131.65 104.46 6.94 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.426 0.691 . . . . 52.32 109.558 -179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -52.21 -38.28 57.47 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.146 0.978 . . . . 72.340000000000003 112.285 -178.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.5 HD11 HD12 ' A' ' 105' ' ' LEU . 22.7 tp -61.89 -42.29 98.9 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 123.975 0.797 . . . . 73.200000000000003 111.769 179.098 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.47 -44.12 95.37 Favored 'General case' 0 C--N 1.351 0.669 0 O-C-N 123.66 0.6 . . . . 74.319999999999993 110.804 -177.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.433 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 98.6 mt-30 -54.86 -48.04 73.43 Favored 'General case' 0 C--N 1.348 0.525 0 O-C-N 124.122 0.889 . . . . 74.540000000000006 110.643 176.579 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -63.48 -44.62 93.87 Favored 'General case' 0 CA--C 1.552 1.028 0 O-C-N 123.87 0.731 . . . . 71.319999999999993 112.84 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -65.77 -49.68 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 123.328 0.651 . . . . 53.530000000000001 110.868 -176.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -69.93 -30.0 67.29 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.656 0.382 . . . . 74.439999999999998 111.809 -178.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 67.1 tp -64.11 -48.72 75.01 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.59 0.756 . . . . 72.409999999999997 110.693 175.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -86.78 -16.88 34.93 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.068 -0.969 . . . . 71.219999999999999 111.943 -173.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 54.0 t -149.44 104.62 3.29 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 122.928 0.491 . . . . 73.120000000000005 110.383 177.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -78.94 5.72 5.49 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.671 2.247 . . . . 63.409999999999997 112.765 172.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.23 -26.68 67.76 Favored Glycine 0 C--N 1.354 1.539 0 N-CA-C 112.262 -0.335 . . . . 44.210000000000001 112.262 176.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 40.7 t -75.36 127.73 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.056 0.542 . . . . 60.329999999999998 110.368 -176.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -89.06 -36.43 15.78 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.282 1.033 . . . . 53.200000000000003 111.026 -177.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.1 p -164.63 162.02 21.24 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 121.339 0.59 . . . . 62.509999999999998 111.633 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.9 mt -118.72 131.14 56.13 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.609 1.163 . . . . 62.539999999999999 108.168 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.514 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 43.0 ttm -105.21 103.85 13.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.407 -0.96 . . . . 54.329999999999998 108.407 175.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.478 HD13 HD13 ' A' ' 84' ' ' LEU . 49.3 mm -82.38 106.92 13.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 124.447 1.099 . . . . 75.129999999999995 108.773 -177.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.54 -163.9 39.55 Favored Glycine 0 C--O 1.246 0.863 0 O-C-N 123.688 0.617 . . . . 74.239999999999995 111.876 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -64.24 -66.16 0.58 Allowed 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.61 0.719 . . . . 65.340000000000003 110.036 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -127.89 10.57 6.51 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 114.055 -1.43 . . . . 71.230000000000004 109.603 -175.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -132.52 153.59 50.79 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.987 0.915 . . . . 73.549999999999997 110.344 -174.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.478 HD13 HD13 ' A' ' 79' ' ' ILE . 46.0 tp -131.64 117.96 19.39 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.221 1.008 . . . . 63.030000000000001 109.524 -175.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.514 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 28.9 m -105.16 111.43 24.19 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.288 -0.634 . . . . 75.0 109.288 -178.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.511 HG13 HD13 ' A' ' 101' ' ' ILE . 22.4 mm -88.01 126.99 41.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 123.31 0.644 . . . . 73.540000000000006 109.335 -175.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -104.2 109.61 21.5 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.227 -1.027 . . . . 62.409999999999997 108.227 174.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.84 166.24 10.62 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.617 0.767 . . . . 61.210000000000001 111.047 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -69.42 142.91 53.75 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 124.214 0.946 . . . . 63.140000000000001 110.117 175.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -54.9 -29.25 55.41 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 124.494 1.118 . . . . 71.129999999999995 113.429 -173.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 90.6 mmm -83.54 -31.72 26.25 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.128 0.571 . . . . 65.010000000000005 111.913 -178.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . 0.545 HG12 HD11 ' A' ' 97' ' ' ILE . 17.9 t -88.23 122.95 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 109.592 -0.521 . . . . 70.209999999999994 109.592 -170.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -95.18 152.02 18.71 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.243 0.617 . . . . 61.439999999999998 111.281 -166.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -62.3 -26.21 68.29 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.725 0.81 . . . . 73.140000000000001 112.683 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -51.74 -33.42 34.62 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.024 0.929 . . . . 72.319999999999993 112.487 -178.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 43.0 p -91.46 -45.49 8.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.302 0.641 . . . . 74.519999999999996 111.416 178.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.545 HD11 HG12 ' A' ' 92' ' ' VAL . 4.9 mt -79.89 -47.15 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 122.409 0.283 . . . . 74.409999999999997 110.959 -163.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -50.77 -53.17 49.87 Favored Pre-proline 0 N--CA 1.487 1.389 0 N-CA-C 114.845 1.424 . . . . 73.430000000000007 114.845 -170.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.32 -36.19 95.09 Favored 'Trans proline' 0 C--N 1.385 2.461 0 C-N-CA 121.784 1.656 . . . . 74.340000000000003 112.396 -177.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.421 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 45.2 mt-10 -76.83 -30.84 56.52 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 114.819 -1.082 . . . . 64.010000000000005 111.503 -177.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.511 HD13 HG13 ' A' ' 86' ' ' ILE . 69.1 mt -66.32 -52.7 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 N-CA-C 109.604 -0.517 . . . . 74.439999999999998 109.604 173.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . 0.403 HG23 ' HB ' ' A' ' 19' ' ' ILE . 73.6 mt -57.66 -37.41 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 123.967 0.792 . . . . 72.129999999999995 110.745 -178.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -58.97 -44.22 91.49 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.931 0.893 . . . . 65.530000000000001 111.165 175.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 81.8 mt -67.72 -33.35 74.71 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.673 0.789 . . . . 54.119999999999997 111.548 177.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.5 HD12 HD11 ' A' ' 63' ' ' LEU . 11.1 mp -70.09 -22.7 63.01 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.14 0.576 . . . . 54.039999999999999 110.696 174.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . 0.458 ' HA ' ' HB ' ' A' ' 17' ' ' ILE . 25.3 m -82.45 -35.83 27.15 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 109.459 -0.571 . . . . 73.129999999999995 109.459 177.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -71.87 -64.23 0.98 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.187 0.595 . . . . 64.209999999999994 111.798 178.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.453 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 2.8 tt0 -58.79 -48.65 80.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.149 0.579 . . . . 73.209999999999994 112.1 -167.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.87 -25.46 66.69 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 124.072 0.858 . . . . 55.520000000000003 111.919 -176.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.05 -30.1 63.47 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.52 0.728 . . . . 75.530000000000001 111.332 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -87.45 -27.44 22.7 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.265 0.626 . . . . 73.200000000000003 110.463 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 177.28 123.86 0.81 Allowed Glycine 0 C--N 1.341 0.841 0 N-CA-C 111.492 -0.643 . . . . 54.5 111.492 -176.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -26.34 67.86 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.186 0.994 . . . . 73.340000000000003 112.118 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -60.59 102.16 0.17 Allowed 'General case' 0 CA--C 1.545 0.781 0 O-C-N 123.507 0.505 . . . . 71.319999999999993 110.913 173.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 8.1 p . . . . . 0 C--N 1.353 0.761 0 N-CA-C 109.365 -0.606 . . . . 74.209999999999994 109.365 169.873 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.2 mt . . . . . 0 C--O 1.24 0.594 0 N-CA-C 109.965 -0.383 . . . . 74.239999999999995 109.965 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -67.67 115.44 7.25 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.229 1.012 . . . . 72.140000000000001 109.91 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 40.8 mm -128.99 114.69 33.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 N-CA-C 105.272 -2.121 . . . . 75.349999999999994 105.272 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -100.06 137.14 38.92 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 109.273 -0.64 . . . . 64.019999999999996 109.273 -172.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.2 m -92.15 120.67 32.97 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.832 0.853 . . . . 73.319999999999993 109.852 -176.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 71.1 mt -128.62 137.95 51.94 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.135 0.974 . . . . 75.329999999999998 108.819 -179.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 44.5 p -87.55 147.25 25.42 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.018 0.527 . . . . 64.25 110.084 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.5 p -109.96 165.92 11.75 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 108.796 -0.816 . . . . 55.329999999999998 108.796 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -66.42 -16.68 52.04 Favored 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.008 1.805 . . . . 71.230000000000004 111.849 169.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -79.72 135.28 36.49 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.209 1.003 . . . . 65.219999999999999 109.347 178.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -80.94 147.91 30.06 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.949 0.5 . . . . 73.209999999999994 109.747 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 55.44 23.91 6.26 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.575 1.15 . . . . 73.200000000000003 112.631 -178.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -128.55 121.61 29.18 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 124.742 1.217 . . . . 62.409999999999997 107.959 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.6 tp -126.93 125.46 41.58 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.677 -0.49 . . . . 74.120000000000005 109.677 -173.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -82.82 107.24 15.29 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.248 1.019 . . . . 71.200000000000003 110.462 -177.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -93.46 116.12 28.66 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.203 -1.036 . . . . 75.120000000000005 108.203 173.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 43.7 tp -102.75 125.54 49.53 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.52 0.728 . . . . 75.319999999999993 109.181 -173.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 p -73.71 102.56 4.0 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 107.611 -1.255 . . . . 75.200000000000003 107.611 170.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.6 m -82.44 -33.01 28.7 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.981 0.913 . . . . 74.129999999999995 111.741 -164.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -60.49 -41.14 93.65 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.337 0.655 . . . . 60.530000000000001 111.537 177.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.76 7.43 1.39 Allowed Glycine 0 C--N 1.342 0.872 0 CA-C-O 119.097 -0.835 . . . . 62.539999999999999 114.032 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -64.31 151.0 44.99 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 117.67 0.735 . . . . 73.140000000000001 109.795 175.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 17.0 ttt -125.88 131.07 52.44 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.453 -0.573 . . . . 65.25 109.453 -178.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.4 mt -95.05 -46.84 6.64 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.432 0.693 . . . . 73.420000000000002 111.462 -171.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.435 ' NE2' HG13 ' A' ' 48' ' ' ILE . 6.3 tp-100 . . . . . 0 N--CA 1.483 1.203 0 C-N-CA 123.028 0.531 . . . . 72.040000000000006 110.305 175.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 26.0 t . . . . . 0 N--CA 1.479 0.999 0 CA-C-O 120.747 0.308 . . . . 73.420000000000002 110.587 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -80.17 155.62 27.34 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.055 0.942 . . . . 75.519999999999996 112.103 -174.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.2 m -67.29 107.63 2.45 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.01 0.924 . . . . 73.120000000000005 110.147 175.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.435 HG13 ' NE2' ' A' ' 41' ' ' GLN . 39.4 mt -73.85 100.67 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 109.694 -0.484 . . . . 62.530000000000001 109.694 -175.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.2 t -84.51 106.67 14.9 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 N-CA-C 107.975 -1.12 . . . . 74.329999999999998 107.975 175.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.474 HG23 ' HB3' ' A' ' 57' ' ' LEU . 54.5 mt -95.49 106.87 18.8 Favored 'Isoleucine or valine' 0 C--N 1.34 0.153 0 N-CA-C 107.828 -1.175 . . . . 73.450000000000003 107.828 -175.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.447 ' HE3' ' HB2' ' A' ' 54' ' ' ASP . 47.1 mtmt -91.64 135.39 33.91 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.161 -0.681 . . . . 72.319999999999993 109.161 -177.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.444 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 36.1 p30 -63.12 -23.58 67.51 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.169 0.587 . . . . 61.219999999999999 111.814 177.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.4 t -80.97 -13.96 58.4 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.898 0.879 . . . . 64.120000000000005 111.469 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.447 ' HB2' ' HE3' ' A' ' 51' ' ' LYS . 12.8 t0 -111.38 79.27 1.19 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.116 -1.068 . . . . 65.120000000000005 108.116 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -55.58 -32.68 63.26 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 125.627 1.571 . . . . 55.310000000000002 113.609 -169.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -62.45 -31.58 72.32 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.076 0.951 . . . . 55.439999999999998 111.928 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.474 ' HB3' HG23 ' A' ' 50' ' ' ILE . 75.4 mt -67.77 -35.46 78.74 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.846 0.858 . . . . 75.140000000000001 111.518 174.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.98 -48.72 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 108.554 -0.906 . . . . 74.319999999999993 108.554 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -54.1 -31.14 51.13 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.803 1.241 . . . . 64.239999999999995 112.726 -176.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.5 m170 -86.99 -45.67 10.55 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.059 0.543 . . . . 51.329999999999998 110.996 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 22.2 m -87.35 106.1 17.71 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.081 0.553 . . . . 74.430000000000007 111.792 -172.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.0 ttmm -49.61 -52.2 32.14 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 125.542 1.537 . . . . 74.319999999999993 112.726 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.638 HD11 HD12 ' A' ' 105' ' ' LEU . 33.7 tp -61.79 -36.0 79.8 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.699 -1.137 . . . . 71.0 111.451 -177.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.429 ' HA ' HD11 ' A' ' 77' ' ' LEU . . . -65.32 -41.3 94.14 Favored 'General case' 0 C--N 1.352 0.703 0 C-N-CA 123.236 0.614 . . . . 75.439999999999998 111.161 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 61' ' ' SER . 78.5 mt-30 -56.21 -49.97 72.59 Favored 'General case' 0 C--N 1.352 0.684 0 O-C-N 124.143 0.902 . . . . 74.430000000000007 109.901 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.467 ' HB3' HD22 ' A' ' 104' ' ' LEU . 29.5 mm-40 -61.17 -50.75 71.87 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.305 1.042 . . . . 61.450000000000003 113.38 179.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 74.1 mt -66.17 -46.78 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 C-N-CA 122.839 0.456 . . . . 70.040000000000006 111.131 -174.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -70.42 -30.47 67.34 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.867 0.467 . . . . 73.040000000000006 112.054 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.9 tp -68.51 -58.79 3.78 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.75 0.42 . . . . 73.340000000000003 110.464 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.23 -19.54 56.49 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.563 -0.744 . . . . 71.230000000000004 112.015 -175.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.496 ' SG ' HG23 ' A' ' 97' ' ' ILE . 63.8 m -139.45 81.32 20.54 Favored Pre-proline 0 CA--C 1.554 1.127 0 N-CA-C 109.103 -0.703 . . . . 72.439999999999998 109.103 176.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.4 -6.93 16.18 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 122.988 2.459 . . . . 64.430000000000007 113.749 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -79.55 -7.37 88.54 Favored Glycine 0 C--N 1.353 1.475 0 CA-C-O 120.016 -0.325 . . . . 72.319999999999993 113.124 178.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 98.8 t -79.21 130.61 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 123.609 0.764 . . . . 72.400000000000006 109.225 172.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . 0.444 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 20.7 mm-40 -87.09 -46.76 9.49 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.145 0.978 . . . . 72.450000000000003 111.478 -176.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.7 p -157.88 156.53 31.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.697 -0.683 . . . . 73.549999999999997 110.838 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . 0.429 HD11 ' HA ' ' A' ' 64' ' ' ALA . 38.8 mt -108.18 167.21 10.17 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 107.931 -1.137 . . . . 73.319999999999993 107.931 171.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.587 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.9 ttm -142.8 103.89 4.26 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 106.871 -1.529 . . . . 70.109999999999999 106.871 169.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.487 HD13 HD13 ' A' ' 84' ' ' LEU . 28.9 mm -77.21 100.74 2.84 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 N-CA-C 107.73 -1.211 . . . . 73.340000000000003 107.73 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.15 173.02 32.63 Favored Glycine 0 C--O 1.241 0.568 0 N-CA-C 110.645 -0.982 . . . . 70.109999999999999 110.645 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -55.68 -66.61 0.39 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.901 0.881 . . . . 42.049999999999997 110.351 -173.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -105.05 -0.74 26.46 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 114.144 -1.389 . . . . 72.019999999999996 110.984 -176.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -137.7 168.16 20.24 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 122.947 0.499 . . . . 74.349999999999994 111.709 -166.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.487 HD13 HD13 ' A' ' 79' ' ' ILE . 48.9 tp -139.4 114.19 9.34 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.23 1.012 . . . . 70.150000000000006 108.71 176.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.587 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 31.0 m -96.13 106.63 18.84 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.481 -0.933 . . . . 74.439999999999998 108.481 -178.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.532 HG13 HD13 ' A' ' 101' ' ' ILE . 20.2 mm -87.87 117.96 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 108.103 -1.073 . . . . 65.109999999999999 108.103 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -104.58 125.7 50.96 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 107.522 -1.288 . . . . 70.430000000000007 107.522 174.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.403 ' HA ' ' H ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -134.46 169.89 16.57 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.553 0.741 . . . . 62.520000000000003 110.841 -174.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -81.37 142.51 32.96 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 115.535 -0.757 . . . . 71.010000000000005 109.263 178.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -80.25 0.96 30.41 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.893 0.877 . . . . 74.299999999999997 112.906 -173.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 23.1 ptp -78.34 -22.53 47.9 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 120.679 0.276 . . . . 73.25 110.552 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 18.9 t -102.54 147.35 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 123.743 0.817 . . . . 61.229999999999997 109.666 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -76.14 158.67 31.49 Favored 'General case' 0 CA--C 1.564 1.488 0 C-N-CA 124.1 0.96 . . . . 62.219999999999999 110.618 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 2.2 m95 -82.04 -56.03 4.2 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.703 0.801 . . . . 72.120000000000005 112.179 -179.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -60.8 -18.8 57.54 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 124.563 1.145 . . . . 72.340000000000003 112.276 -177.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 71.9 p -77.04 -39.29 50.61 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.673 0.789 . . . . 74.129999999999995 110.647 177.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.496 HG23 ' SG ' ' A' ' 71' ' ' CYS . 28.8 mt -79.93 -29.55 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.281 0 C-N-CA 123.631 0.772 . . . . 74.329999999999998 110.655 178.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -57.74 -45.2 99.84 Favored Pre-proline 0 CA--C 1.578 2.029 0 N-CA-C 114.608 1.336 . . . . 74.209999999999994 114.608 -169.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -62.72 -32.81 78.28 Favored 'Trans proline' 0 C--N 1.398 3.169 0 CA-C-N 122.185 1.816 . . . . 73.349999999999994 111.557 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -63.29 -51.25 66.86 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.888 0.875 . . . . 73.549999999999997 110.019 174.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.532 HD13 HG13 ' A' ' 86' ' ' ILE . 83.2 mt -58.65 -56.05 19.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.495 0.718 . . . . 74.219999999999999 110.684 -178.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 67.4 mt -55.61 -39.57 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 C-N-CA 123.727 0.811 . . . . 73.310000000000002 111.173 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.72 -50.95 69.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.336 0.654 . . . . 75.409999999999997 111.01 178.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.467 HD22 ' HB3' ' A' ' 66' ' ' GLN . 74.4 mt -67.13 -32.7 74.0 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.11 0.964 . . . . 73.319999999999993 111.883 -176.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.638 HD12 HD11 ' A' ' 63' ' ' LEU . 9.5 mp -69.88 -29.17 66.32 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.683 0.793 . . . . 65.140000000000001 109.998 173.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 52.4 m -74.94 -45.51 41.93 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 109.689 -0.485 . . . . 71.519999999999996 109.689 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -60.04 -49.89 75.87 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.166 0.986 . . . . 74.25 110.793 -176.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.551 HE21 ' HA ' ' A' ' 115' ' ' VAL . 36.4 tt0 -53.29 -59.2 4.87 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 124.395 1.059 . . . . 73.409999999999997 111.065 177.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 59.7 mt -72.94 -13.5 61.26 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 114.915 -1.039 . . . . 64.209999999999994 111.691 -172.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.36 -27.76 59.29 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.98 0.912 . . . . 74.209999999999994 111.143 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -87.41 -43.95 11.71 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.076 0.55 . . . . 75.439999999999998 109.571 173.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -178.13 159.21 24.61 Favored Glycine 0 C--N 1.344 0.983 0 CA-C-N 115.544 -0.753 . . . . 51.200000000000003 112.587 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -62.08 -29.0 70.01 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.402 1.081 . . . . 61.399999999999999 112.426 -178.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -59.9 140.69 56.49 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.233 1.013 . . . . 72.219999999999999 112.626 -172.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.551 ' HA ' HE21 ' A' ' 108' ' ' GLN . 8.6 p . . . . . 0 CA--C 1.544 0.718 0 N-CA-C 108.576 -0.898 . . . . 64.219999999999999 108.576 168.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 75.8 mt . . . . . 0 N--CA 1.468 0.464 0 N-CA-C 107.778 -1.193 . . . . 64.340000000000003 107.778 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -75.69 112.38 12.0 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.433 0.693 . . . . 72.120000000000005 109.877 -169.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 44.8 mm -119.97 112.23 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 107.717 -1.216 . . . . 73.120000000000005 107.717 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.2 ttmm -91.99 126.55 37.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.932 0.893 . . . . 72.239999999999995 109.514 -173.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.9 m -90.28 120.6 31.56 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 108.837 -0.801 . . . . 71.109999999999999 108.837 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.415 ' HB2' ' HG3' ' A' ' 31' ' ' LYS . 97.7 mt -128.04 139.6 52.44 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.043 0.937 . . . . 62.240000000000002 109.071 -179.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 72.4 p -83.68 160.94 21.22 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.166 0.586 . . . . 74.439999999999998 110.192 177.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 43.1 p -115.77 162.25 26.36 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 108.664 -0.865 . . . . 74.209999999999994 108.664 175.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -58.37 -16.35 28.45 Favored 'Trans proline' 0 C--N 1.377 2.027 0 C-N-CA 122.844 2.363 . . . . 72.329999999999998 113.37 167.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . 0.445 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 28.0 t-20 -84.26 151.02 25.05 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.308 0.643 . . . . 64.519999999999996 110.723 176.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -67.04 -52.85 37.25 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 124.304 1.042 . . . . 62.130000000000003 112.594 -176.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -106.97 18.72 21.44 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.678 0.791 . . . . 73.230000000000004 111.253 -168.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.445 ' HB3' ' HB3' ' A' ' 26' ' ' ASN . . . -111.94 128.34 56.13 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.535 0.734 . . . . 34.43 109.272 177.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.9 tp -137.56 116.23 12.16 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 107.296 -1.372 . . . . 72.329999999999998 107.296 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 85' ' ' THR . 60.9 pttt -94.87 150.07 20.57 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.442 0.639 . . . . 74.140000000000001 111.194 -176.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -124.32 122.52 37.94 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.569 1.147 . . . . 60.229999999999997 108.113 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 26.7 tp -104.12 126.64 51.39 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 124.003 0.921 . . . . 72.010000000000005 109.613 -165.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.5 p -85.24 106.56 16.75 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.424 0.689 . . . . 65.329999999999998 109.142 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.6 p -96.14 -8.42 33.27 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.385 0.674 . . . . 63.030000000000001 112.66 -170.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.32 -32.8 37.91 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.75 0.82 . . . . 74.150000000000006 112.858 -169.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 121.41 -23.1 7.68 Favored Glycine 0 N--CA 1.475 1.248 0 N-CA-C 111.048 -0.821 . . . . 71.319999999999993 111.048 -171.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -68.06 96.76 0.64 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.456 -0.942 . . . . 75.150000000000006 108.456 168.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.8 ttt -79.71 139.24 37.41 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.593 0.757 . . . . 73.430000000000007 109.194 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.579 HD23 HD21 ' A' ' 109' ' ' LEU . 87.9 mt -60.1 -34.55 73.63 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.202 0.601 . . . . 63.450000000000003 112.2 -178.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . 0.58 HE22 HD12 ' A' ' 48' ' ' ILE . 25.6 tt0 . . . . . 0 C--O 1.24 0.583 0 O-C-N 124.3 1.0 . . . . 65.219999999999999 109.672 -177.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 76.7 p . . . . . 0 N--CA 1.483 1.193 0 N-CA-C 110.146 -0.316 . . . . 51.350000000000001 110.146 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.36 73.14 1.44 Allowed 'General case' 0 N--CA 1.488 1.46 0 CA-C-O 121.432 0.634 . . . . 72.109999999999999 111.772 -174.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.2 m 51.85 69.33 0.68 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.286 1.034 . . . . 72.239999999999995 111.488 -178.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.58 HD12 HE22 ' A' ' 41' ' ' GLN . 57.6 mt -75.85 99.21 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.587 -0.523 . . . . 62.409999999999997 109.587 -175.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 94.0 t -80.25 124.2 37.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 108.196 -1.038 . . . . 65.409999999999997 108.196 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 45.7 mt -105.02 109.37 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 108.29 -1.004 . . . . 72.439999999999998 108.29 -179.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -79.6 140.2 37.22 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.736 -0.468 . . . . 73.439999999999998 109.736 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -65.75 -23.83 66.82 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.784 0.433 . . . . 75.549999999999997 111.388 176.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -85.58 -19.61 30.8 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.725 0.81 . . . . 61.210000000000001 111.791 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -92.35 95.39 9.65 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 108.572 -0.899 . . . . 73.230000000000004 108.572 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -53.08 -40.15 63.85 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.369 1.068 . . . . 72.230000000000004 113.023 178.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -67.43 -44.15 79.43 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.514 0.726 . . . . 73.310000000000002 112.162 -169.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 97.7 mt -61.84 -35.09 77.25 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.464 0.706 . . . . 53.020000000000003 111.31 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.507 HG22 ' HG2' ' A' ' 65' ' ' GLN . 53.7 mt -77.71 -34.0 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 CA-C-N 115.068 -0.969 . . . . 72.329999999999998 110.205 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -59.62 -36.44 76.32 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.181 0.592 . . . . 70.299999999999997 111.268 174.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.7 m170 -74.75 -39.23 61.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.499 0.72 . . . . 64.019999999999996 111.117 178.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 43.7 t -104.45 98.78 8.51 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.431 0.692 . . . . 73.25 110.646 -176.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -61.13 -32.31 72.01 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.939 0.496 . . . . 73.5 110.659 173.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.0 tp -58.27 -40.33 81.56 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.024 0.93 . . . . 64.409999999999997 110.713 174.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.04 -40.93 91.42 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.209 0.604 . . . . 64.129999999999995 111.544 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.507 ' HG2' HG22 ' A' ' 58' ' ' ILE . 91.9 mt-30 -55.68 -47.08 77.35 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.901 0.751 . . . . 73.329999999999998 110.162 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -62.99 -51.03 68.44 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.956 -1.02 . . . . 72.310000000000002 112.84 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -65.05 -45.83 93.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.062 0.545 . . . . 64.349999999999994 111.291 -174.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -69.37 -33.06 72.49 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.791 0.436 . . . . 71.019999999999996 112.053 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 52.8 tp -70.99 -42.69 69.32 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.709 0.404 . . . . 74.430000000000007 111.192 177.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . 0.451 HE22 HD21 ' A' ' 104' ' ' LEU . 78.7 mt-30 -74.95 -26.67 59.77 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.164 0.586 . . . . 72.439999999999998 111.475 -178.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.5 t -146.88 103.58 3.88 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 122.826 0.45 . . . . 74.030000000000001 110.074 178.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -78.73 7.23 4.36 Favored 'Trans proline' 0 C--N 1.373 1.866 0 C-N-CA 122.757 2.305 . . . . 63.539999999999999 112.928 173.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -78.51 -25.76 60.39 Favored Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.149 -0.38 . . . . 71.439999999999998 112.149 171.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 42.2 t -69.43 121.96 19.97 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.186 0.594 . . . . 52.140000000000001 110.167 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -74.49 -48.33 27.89 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.252 1.021 . . . . 74.239999999999995 110.538 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 62.0 p -162.81 166.42 24.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.607 -1.178 . . . . 62.219999999999999 110.326 -173.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.2 mt -111.69 169.86 8.54 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.0 -1.111 . . . . 75.319999999999993 108.0 171.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.528 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 56.0 ttm -143.14 115.43 8.46 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.517 -1.29 . . . . 72.349999999999994 107.517 170.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.541 HD13 HD13 ' A' ' 84' ' ' LEU . 42.7 mm -84.89 104.64 13.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 107.943 -1.132 . . . . 51.530000000000001 107.943 179.333 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -85.46 173.31 47.75 Favored Glycine 0 C--O 1.244 0.751 0 N-CA-C 109.442 -1.463 . . . . 52.130000000000003 109.442 167.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.32 -52.39 64.88 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.224 0.61 . . . . 64.219999999999999 110.724 -176.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -123.96 5.06 8.67 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 115.368 -0.833 . . . . 73.340000000000003 111.879 -176.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -140.2 133.92 30.41 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.982 0.513 . . . . 74.099999999999994 110.379 -175.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.663 HD23 HD11 ' A' ' 105' ' ' LEU . 32.8 tp -103.27 114.61 29.03 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 109.445 -0.576 . . . . 60.439999999999998 109.445 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.528 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 18.4 m -97.81 113.27 25.02 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.35 0.66 . . . . 73.310000000000002 109.558 -177.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.608 HG13 HD13 ' A' ' 101' ' ' ILE . 30.1 mm -89.01 128.35 41.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 108.307 -0.997 . . . . 74.439999999999998 108.307 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -117.94 110.94 18.33 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 108.366 -0.976 . . . . 71.430000000000007 108.366 -177.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . 0.497 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -117.26 174.28 6.21 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.053 0.541 . . . . 72.409999999999997 111.332 -174.467 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -74.02 131.71 41.65 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 108.511 -0.922 . . . . 61.109999999999999 108.511 172.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -56.35 -30.37 62.56 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.958 1.096 . . . . 73.299999999999997 113.958 -172.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.7 mtp -76.79 -9.33 58.6 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.98 0.512 . . . . 73.409999999999997 112.228 -176.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 39.6 t -95.77 138.62 20.86 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.323 1.049 . . . . 54.420000000000002 108.475 176.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -79.46 160.5 26.56 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.349 0.66 . . . . 75.340000000000003 111.165 -176.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 22.7 m95 -80.3 -51.87 8.38 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.115 0.566 . . . . 72.230000000000004 112.124 176.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -60.9 -18.19 55.05 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.786 0.834 . . . . 70.439999999999998 112.663 -171.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.9 m -71.46 -49.68 39.1 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.335 0.654 . . . . 62.140000000000001 110.717 175.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 6.7 mt -85.23 -31.1 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 CA-C-N 115.234 -0.893 . . . . 73.230000000000004 111.043 -173.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.2 ttpm? -53.66 -50.11 85.18 Favored Pre-proline 0 CA--C 1.559 1.309 0 C-N-CA 124.566 1.146 . . . . 74.129999999999995 113.993 -167.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -58.96 -35.86 97.85 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 122.014 1.81 . . . . 75.329999999999998 112.329 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.93 -37.86 82.18 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.601 -0.727 . . . . 74.109999999999999 110.668 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.608 HD13 HG13 ' A' ' 86' ' ' ILE . 69.3 mt -65.51 -54.05 32.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 123.676 0.79 . . . . 70.239999999999995 109.677 177.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 87.3 mt -54.32 -39.34 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 124.053 0.941 . . . . 62.240000000000002 111.317 -177.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.13 -49.1 75.74 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 115.087 -0.96 . . . . 72.150000000000006 111.3 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.451 HD21 HE22 ' A' ' 70' ' ' GLN . 95.0 mt -65.49 -33.46 76.0 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.75 0.82 . . . . 61.43 112.471 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.663 HD11 HD23 ' A' ' 84' ' ' LEU . 9.7 mp -71.78 -27.26 62.83 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.251 0.62 . . . . 53.200000000000003 111.324 175.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.1 m -72.28 -32.47 66.65 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 109.379 -0.601 . . . . 73.129999999999995 109.379 173.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.454 ' HA ' ' HE2' ' A' ' 107' ' ' LYS . 9.1 mmpt? -69.28 -45.62 69.21 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.454 0.701 . . . . 64.239999999999995 111.105 177.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.599 HE21 ' HB ' ' A' ' 115' ' ' VAL . 1.1 tm0? -61.12 -54.24 47.02 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.902 0.881 . . . . 64.409999999999997 109.314 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . 0.579 HD21 HD23 ' A' ' 40' ' ' LEU . 97.7 mt -74.37 -14.67 60.9 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 114.729 -1.123 . . . . 73.530000000000001 112.26 -174.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.59 -35.81 78.89 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.993 0.517 . . . . 64.319999999999993 110.355 171.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . 0.502 ' HB2' ' HG2' ' A' ' 113' ' ' GLU . 93.0 m-85 -87.09 -34.6 19.08 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.486 -0.779 . . . . 64.200000000000003 109.713 171.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 79.78 52.02 4.87 Favored Glycine 0 C--N 1.349 1.292 0 N-CA-C 110.685 -0.966 . . . . 51.520000000000003 110.685 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . 0.502 ' HG2' ' HB2' ' A' ' 111' ' ' TYR . 32.5 mm-40 -82.35 154.73 25.11 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.521 0.728 . . . . 75.340000000000003 112.412 -172.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -89.05 98.72 11.92 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 106.202 -1.777 . . . . 73.239999999999995 106.202 159.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . 0.599 ' HB ' HE21 ' A' ' 108' ' ' GLN . 3.5 p . . . . . 0 N--CA 1.487 1.413 0 C-N-CA 125.653 1.581 . . . . 75.209999999999994 114.677 -168.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 85.6 mt . . . . . 0 C--O 1.237 0.443 0 N-CA-C 109.431 -0.581 . . . . 74.329999999999998 109.431 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -67.61 127.98 34.74 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 114.591 -1.186 . . . . 74.219999999999999 109.761 -173.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.1 mm -119.95 118.71 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 106.491 -1.67 . . . . 60.329999999999998 106.491 -175.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -95.06 129.75 42.03 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.23 -1.026 . . . . 71.439999999999998 108.23 -175.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.6 t -100.56 130.86 46.68 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.489 0.716 . . . . 50.5 109.379 -178.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.1 mt -126.67 138.82 53.47 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.377 1.071 . . . . 74.230000000000004 108.668 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 40.1 p -73.71 149.2 42.01 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.458 0.703 . . . . 61.030000000000001 110.897 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 72.6 p -122.89 167.57 14.15 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.819 1.248 . . . . 64.120000000000005 108.028 -176.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' PRO . . . . . 0.425 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 17.9 Cg_endo -56.78 -18.19 26.1 Favored 'Trans proline' 0 C--N 1.39 2.735 0 C-N-CA 122.364 2.042 . . . . 65.510000000000005 113.426 177.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -109.61 133.24 53.33 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.602 0.761 . . . . 71.400000000000006 109.466 176.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.33 -21.76 62.88 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.283 0.633 . . . . 71.129999999999995 110.185 166.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -59.95 -47.23 86.65 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.608 1.563 . . . . 73.030000000000001 110.469 173.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.55 160.52 15.0 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 114.3 -1.318 . . . . 52.149999999999999 110.181 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.0 tp -158.18 128.55 6.17 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.787 -0.82 . . . . 75.030000000000001 108.787 173.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -82.37 127.01 32.83 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.988 0.915 . . . . 73.230000000000004 110.358 -176.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' PHE . . . . . 0.45 ' CZ ' ' HG3' ' A' ' 98' ' ' LYS . 80.1 m-85 -114.75 116.71 29.09 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.562 1.145 . . . . 73.540000000000006 108.344 175.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.0 tp -114.8 129.96 56.78 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 124.069 0.948 . . . . 74.200000000000003 109.33 -169.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.8 t -100.02 103.87 15.43 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 108.126 -1.064 . . . . 42.350000000000001 108.126 174.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.0 p -104.24 -6.61 20.76 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.096 0.958 . . . . 73.420000000000002 109.754 176.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.85 -60.42 3.68 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 124.648 1.179 . . . . 70.299999999999997 111.725 -168.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -161.1 -81.54 0.04 OUTLIER Glycine 0 C--N 1.338 0.678 0 N-CA-C 111.114 -0.794 . . . . 52.140000000000001 111.114 176.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.21 119.91 17.08 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.471 0.708 . . . . 42.340000000000003 109.659 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 48.4 ttp -97.38 155.61 16.83 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.04 -0.982 . . . . 73.420000000000002 109.332 -176.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.1 mt -58.68 -62.29 1.97 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.115 1.154 . . . . 74.510000000000005 114.115 -169.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 . . . . . 0 N--CA 1.484 1.235 0 CA-C-O 119.233 -0.413 . . . . 52.009999999999998 110.693 -174.086 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.1 t . . . . . 0 CA--C 1.548 0.897 0 CA-C-O 121.009 0.433 . . . . 63.329999999999998 110.623 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.06 -179.02 5.16 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.185 0.994 . . . . 74.540000000000006 109.635 176.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.8 m -74.61 93.98 2.6 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.435 0.694 . . . . 54.25 110.604 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.506 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 46.6 mt -81.44 97.07 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 N-CA-C 109.126 -0.694 . . . . 65.530000000000001 109.126 175.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.1 t -84.21 107.87 15.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 108.48 -0.933 . . . . 62.420000000000002 108.48 -178.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . 0.506 HG23 ' HB2' ' A' ' 57' ' ' LEU . 55.5 mt -105.61 109.51 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 107.138 -1.43 . . . . 75.120000000000005 107.138 174.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -93.48 171.62 8.79 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.507 -0.553 . . . . 63.439999999999998 109.507 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -56.75 -25.74 55.61 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.248 1.019 . . . . 73.420000000000002 112.638 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.8 t -87.12 -17.07 33.64 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.031 0.932 . . . . 64.239999999999995 111.466 -178.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -84.17 60.09 5.72 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.407 0.683 . . . . 74.140000000000001 110.43 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -61.27 -24.54 66.46 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.278 1.031 . . . . 72.430000000000007 111.577 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -56.18 -51.87 66.44 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.851 0.861 . . . . 73.109999999999999 110.218 172.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.506 ' HB2' HG23 ' A' ' 50' ' ' ILE . 21.8 mt -78.58 -34.95 46.5 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 114.312 -1.313 . . . . 64.219999999999999 110.194 -172.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 78.5 mt -62.88 -47.43 92.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.86 0.864 . . . . 71.140000000000001 110.619 176.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -66.29 -15.63 63.37 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.823 0.675 . . . . 62.039999999999999 112.823 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -87.64 -8.86 55.65 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.726 0.411 . . . . 71.549999999999997 111.955 173.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.1 t -130.39 102.18 6.07 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.579 0.752 . . . . 75.439999999999998 109.175 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -58.49 -28.37 65.33 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.106 0.562 . . . . 65.239999999999995 110.627 176.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.631 HD11 HD12 ' A' ' 105' ' ' LEU . 40.2 tp -62.35 -48.06 81.48 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.501 0.501 . . . . 73.450000000000003 110.358 174.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.81 -45.33 90.18 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 124.075 0.859 . . . . 75.109999999999999 110.075 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -57.74 -44.31 85.98 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 124.357 1.036 . . . . 71.120000000000005 111.018 178.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.448 ' HB3' HD22 ' A' ' 104' ' ' LEU . 17.8 mm100 -68.31 -36.32 79.15 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.339 0.656 . . . . 63.009999999999998 112.308 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 93.3 mt -67.77 -46.79 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.077 0.551 . . . . 72.430000000000007 109.984 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -71.4 -21.73 61.96 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 123.272 0.629 . . . . 63.409999999999997 111.694 176.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.11 -53.1 7.76 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.265 0.626 . . . . 65.329999999999998 110.491 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -84.95 -17.74 36.78 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.541 -0.754 . . . . 72.129999999999995 111.525 -174.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' CYS . . . . . 0.504 ' SG ' HG23 ' A' ' 97' ' ' ILE . 62.2 m -141.34 90.13 9.18 Favored Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 123.251 0.621 . . . . 55.310000000000002 109.602 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -75.31 -1.6 11.5 Favored 'Trans proline' 0 C--N 1.374 1.905 0 C-N-CA 122.784 2.323 . . . . 61.439999999999998 113.1 178.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.07 -22.58 77.68 Favored Glycine 0 C--N 1.351 1.388 0 N-CA-C 111.692 -0.563 . . . . 71.329999999999998 111.692 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.2 t -65.79 121.56 15.09 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 C-N-CA 123.74 0.816 . . . . 65.109999999999999 110.098 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -91.08 -40.34 11.67 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.334 1.054 . . . . 63.210000000000001 110.436 -176.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.2 t -154.18 160.52 41.91 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.595 0.712 . . . . 55.329999999999998 111.501 -175.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 mt -126.65 138.21 53.39 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.053 1.741 . . . . 75.239999999999995 106.803 174.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . 0.417 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 49.9 ttm -116.66 104.63 11.57 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 108.311 -0.996 . . . . 51.310000000000002 108.311 172.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ILE . . . . . 0.772 HD13 HD13 ' A' ' 84' ' ' LEU . 10.6 mm -84.01 112.37 21.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 107.778 -1.193 . . . . 73.040000000000006 107.778 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -96.95 -158.2 31.19 Favored Glycine 0 C--O 1.242 0.627 0 N-CA-C 111.754 -0.538 . . . . 61.399999999999999 111.754 177.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.56 -62.1 1.52 Allowed 'General case' 0 C--O 1.244 0.77 0 C-N-CA 123.796 0.838 . . . . 70.25 109.301 174.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.87 -29.81 12.75 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 113.858 -1.519 . . . . 74.340000000000003 111.05 -174.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -114.64 173.19 6.59 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.275 -0.875 . . . . 72.549999999999997 113.182 -160.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LEU . . . . . 0.772 HD13 HD13 ' A' ' 79' ' ' ILE . 14.7 tp -144.79 117.4 8.62 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.576 1.55 . . . . 74.040000000000006 107.719 175.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 11.3 m -103.62 109.52 21.24 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.914 -0.773 . . . . 60.229999999999997 108.914 -175.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.587 HG13 HD13 ' A' ' 101' ' ' ILE . 18.6 mm -88.46 117.28 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 108.708 -0.849 . . . . 62.140000000000001 108.708 -176.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -101.96 128.74 48.24 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 107.79 -1.189 . . . . 71.120000000000005 107.79 174.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.83 169.91 16.96 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.659 0.384 . . . . 51.219999999999999 110.389 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.18 126.81 28.62 Favored 'General case' 0 C--N 1.35 0.609 0 N-CA-C 109.236 -0.654 . . . . 55.340000000000003 109.236 178.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.6 ptm85 -65.41 -23.17 66.88 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.475 0.917 . . . . 75.519999999999996 113.475 -169.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.6 mmt -79.19 -21.49 46.29 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.921 0.488 . . . . 74.239999999999995 110.937 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.0 t -88.02 145.57 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 108.08 -1.082 . . . . 74.439999999999998 108.08 174.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -106.95 144.06 34.14 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 112.895 0.702 . . . . 73.409999999999997 112.895 -167.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -61.72 -22.99 65.84 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.543 1.137 . . . . 65.439999999999998 112.199 174.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -53.42 -32.9 51.79 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.397 1.079 . . . . 74.340000000000003 112.119 -178.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.7 t -103.45 -20.79 13.93 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.859 0.864 . . . . 74.530000000000001 111.579 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' ILE . . . . . 0.504 HG23 ' SG ' ' A' ' 71' ' ' CYS . 55.5 mt -97.48 -53.65 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 122.886 0.474 . . . . 71.310000000000002 111.344 -170.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' LYS . . . . . 0.45 ' HG3' ' CZ ' ' A' ' 32' ' ' PHE . 3.8 ttpm? -52.48 -47.77 92.3 Favored Pre-proline 0 N--CA 1.49 1.565 0 N-CA-C 114.026 1.121 . . . . 75.230000000000004 114.026 -173.053 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.33 -40.98 82.71 Favored 'Trans proline' 0 C--N 1.394 2.972 0 C-N-CA 122.121 1.881 . . . . 71.510000000000005 112.205 177.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 11.2 mm-40 -69.58 -38.05 77.19 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 115.483 -0.781 . . . . 70.340000000000003 110.36 -177.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.587 HD13 HG13 ' A' ' 86' ' ' ILE . 86.2 mt -60.1 -52.28 63.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.31 0.644 . . . . 70.120000000000005 110.322 176.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 79.6 mt -56.91 -39.24 63.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.462 0.705 . . . . 42.109999999999999 111.026 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -64.25 -42.35 96.54 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.147 0.979 . . . . 71.519999999999996 111.33 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.524 HD23 ' HE2' ' A' ' 107' ' ' LYS . 89.6 mt -64.7 -43.67 92.74 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.497 0.719 . . . . 72.140000000000001 110.765 176.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' LEU . . . . . 0.631 HD12 HD11 ' A' ' 63' ' ' LEU . 11.0 mp -66.88 -24.9 66.17 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.728 0.811 . . . . 71.099999999999994 111.164 178.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 82.9 m -77.39 -48.93 16.0 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.448 0.699 . . . . 65.519999999999996 110.42 178.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' LYS . . . . . 0.524 ' HE2' HD23 ' A' ' 104' ' ' LEU . 0.1 OUTLIER -68.14 -40.36 82.47 Favored 'General case' 0 C--N 1.358 0.968 0 O-C-N 123.337 0.398 . . . . 72.519999999999996 110.969 -174.16 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' GLN . . . . . 0.621 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 20.7 tt0 -55.84 -58.71 6.73 Favored 'General case' 0 C--N 1.358 0.938 0 O-C-N 123.916 0.76 . . . . 65.420000000000002 110.35 177.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 86.8 mt -71.64 -10.8 60.31 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 114.841 -1.072 . . . . 72.439999999999998 111.764 -173.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.71 -37.1 70.69 Favored 'General case' 0 C--N 1.354 0.801 0 C-N-CA 123.269 0.628 . . . . 72.010000000000005 111.173 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -110.39 -19.14 13.06 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.143 0.577 . . . . 52.210000000000001 111.953 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -119.8 163.11 13.8 Favored Glycine 0 C--N 1.339 0.729 0 N-CA-C 111.016 -0.834 . . . . 54.210000000000001 111.016 -176.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -102.88 -24.19 13.7 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.356 0.662 . . . . 73.010000000000005 110.168 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -114.27 158.84 20.87 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.787 0.835 . . . . 75.200000000000003 111.474 -167.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 5.8 p . . . . . 0 CA--C 1.552 1.037 0 C-N-CA 123.891 0.877 . . . . 74.129999999999995 111.123 174.829 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.3 mtp . . . . . 0 N--CA 1.483 1.211 0 N-CA-C 110.119 -0.326 . . . . 65.319999999999993 110.119 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 158.65 77.1 0.02 OUTLIER Glycine 0 C--N 1.348 1.238 0 N-CA-C 112.121 -0.392 . . . . 61.219999999999999 112.121 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 16.7 p80 -66.12 99.4 0.51 Allowed 'General case' 0 CA--C 1.549 0.937 0 CA-C-O 121.57 0.7 . . . . 63.340000000000003 110.207 175.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 47.1 t60 -119.26 -0.98 10.89 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.0 0.52 . . . . 62.140000000000001 111.293 -176.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -66.05 140.96 58.3 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.668 0.387 . . . . 61.030000000000001 110.345 179.426 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 21.4 p80 -155.04 154.97 33.28 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.091 0.556 . . . . 73.109999999999999 110.045 -174.471 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -139.56 134.97 32.9 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.805 -0.813 . . . . 62.009999999999998 108.805 178.674 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -109.11 148.44 30.86 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 122.955 0.502 . . . . 75.540000000000006 110.837 -176.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 27.9 t -75.28 171.79 13.58 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.96 0.904 . . . . 64.530000000000001 111.083 -178.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 14.0 m-70 -92.05 120.01 32.27 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.096 0.558 . . . . 65.430000000000007 110.87 -174.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 17.7 ptp -111.06 86.45 2.32 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 107.94 -1.133 . . . . 70.340000000000003 107.94 169.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 27.8 p-10 -104.26 171.58 7.26 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-N 114.712 -1.131 . . . . 74.329999999999998 111.297 -171.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 23.2 t -103.3 10.66 37.44 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.13 0.972 . . . . 71.549999999999997 110.522 176.16 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.4 tt0 -108.28 96.5 6.4 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 124.053 0.941 . . . . 71.129999999999995 109.42 -176.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 -78.63 6.16 9.42 Favored 'General case' 0 N--CA 1.488 1.426 0 N-CA-C 113.639 0.977 . . . . 71.540000000000006 113.639 -176.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -129.99 140.13 50.94 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 109.112 -0.699 . . . . 74.349999999999994 109.112 175.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.433 ' H ' HG23 ' A' ' 106' ' ' THR . 66.9 mt -120.11 117.13 52.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 107.478 -1.305 . . . . 55.530000000000001 107.478 177.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -64.88 124.7 22.7 Favored 'General case' 0 CA--C 1.544 0.726 0 O-C-N 123.75 0.656 . . . . 74.420000000000002 109.725 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.444 ' HB ' HG23 ' A' ' 102' ' ' ILE . 50.3 mm -116.03 127.37 73.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 N-CA-C 107.313 -1.366 . . . . 73.530000000000001 107.313 -174.188 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -93.63 150.13 20.67 Favored 'General case' 0 C--O 1.237 0.444 0 N-CA-C 108.494 -0.928 . . . . 71.420000000000002 108.494 -178.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 2.9 t -141.28 112.23 7.22 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 123.695 0.798 . . . . 30.219999999999999 109.233 173.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 88.8 mt -99.65 138.97 35.99 Favored 'General case' 0 C--O 1.239 0.551 0 C-N-CA 124.075 0.95 . . . . 72.319999999999993 110.33 -179.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.0 p -80.22 140.2 36.38 Favored 'General case' 0 C--O 1.237 0.4 0 O-C-N 123.748 0.655 . . . . 72.340000000000003 109.453 176.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 63.9 p -107.09 166.08 11.7 Favored Pre-proline 0 CA--C 1.547 0.83 0 C-N-CA 124.539 1.136 . . . . 73.340000000000003 108.712 -176.676 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.71 -7.93 19.67 Favored 'Trans proline' 0 C--N 1.375 1.97 0 C-N-CA 122.375 2.05 . . . . 75.120000000000005 112.743 169.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 16.8 m120 -82.65 151.14 26.42 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 124.222 1.009 . . . . 74.329999999999998 111.628 -178.789 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 18.4 pt-20 -89.4 -31.58 17.68 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 124.086 0.954 . . . . 72.120000000000005 112.357 -171.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -121.82 2.3 9.99 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.269 0.627 . . . . 75.310000000000002 111.921 -174.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -112.54 137.53 50.64 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.91 0.484 . . . . 61.43 110.121 177.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 54.4 tp -136.99 134.59 36.8 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.993 0.517 . . . . 72.530000000000001 109.958 177.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.599 ' HE2' HD12 ' A' ' 33' ' ' LEU . 88.6 tttt -92.2 120.34 32.68 Favored 'General case' 0 CA--C 1.543 0.676 0 C-N-CA 124.296 1.038 . . . . 72.129999999999995 110.629 -175.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 38.4 m-85 -109.81 109.04 19.58 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 108.296 -1.002 . . . . 73.319999999999993 108.296 173.025 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.599 HD12 ' HE2' ' A' ' 31' ' ' LYS . 4.5 tt -111.94 134.18 53.66 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 108.366 -0.976 . . . . 72.329999999999998 108.366 -175.146 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 24.3 m -85.93 111.96 20.73 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.278 0.631 . . . . 63.25 110.006 -178.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.523 HG23 HD22 ' A' ' 33' ' ' LEU . 26.3 p -135.21 90.94 2.68 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.838 0.855 . . . . 72.310000000000002 110.284 179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -174.26 -58.59 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 123.168 0.587 . . . . 55.049999999999997 110.717 176.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -141.53 -72.32 0.03 OUTLIER Glycine 0 C--N 1.342 0.912 0 CA-C-N 115.695 -0.684 . . . . 63.439999999999998 111.528 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.425 ' HB2' ' HB3' ' A' ' 109' ' ' LEU . 25.0 mm-40 -99.74 167.1 10.77 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.182 0.515 . . . . 52.140000000000001 111.195 -178.778 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.446 ' HB2' ' HE2' ' A' ' 39' ' ' MET . 24.1 ptm -131.44 167.66 18.94 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 125.07 1.348 . . . . 71.530000000000001 108.672 179.705 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.416 HD23 HD21 ' A' ' 109' ' ' LEU . 90.2 mt -75.51 -66.69 0.74 Allowed 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 122.738 0.415 . . . . 75.299999999999997 111.191 -173.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -121.53 136.59 54.94 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.264 0.626 . . . . 63.439999999999998 109.426 -172.018 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 5.3 p -59.18 135.55 57.67 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 122.928 0.491 . . . . 71.400000000000006 111.667 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 95.9 mtt180 -63.74 129.73 41.32 Favored 'General case' 0 C--N 1.35 0.618 0 C-N-CA 123.685 0.794 . . . . 73.140000000000001 111.194 -177.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 117.35 1.57 18.26 Favored Glycine 0 C--N 1.333 0.402 0 CA-C-N 115.486 -0.779 . . . . 51.5 111.645 -175.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 48.3 m -98.22 -174.81 2.94 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.806 0.843 . . . . 72.439999999999998 110.097 177.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 23.1 pttm -109.26 162.06 14.66 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.743 0.417 . . . . 63.219999999999999 110.712 -179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.461 ' HA ' ' O ' ' A' ' 79' ' ' ILE . 17.9 p -83.37 97.01 8.71 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 123.393 0.677 . . . . 44.340000000000003 109.555 175.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 56.9 mt -86.06 121.2 37.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.919 0.888 . . . . 70.109999999999999 110.58 -174.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 61.4 t -89.5 108.65 19.46 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.608 0 N-CA-C 109.591 -0.522 . . . . 72.030000000000001 109.591 179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 60.7 mt -97.16 110.2 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.915 -0.772 . . . . 71.219999999999999 108.915 -176.746 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -93.74 151.93 19.29 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.288 0.635 . . . . 71.420000000000002 110.059 -175.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.466 ' HA ' HD11 ' A' ' 58' ' ' ILE . 9.1 p30 -66.36 -22.68 66.26 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 122.722 0.409 . . . . 71.400000000000006 111.483 178.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 33.4 p -83.35 -32.81 26.05 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 123.578 0.751 . . . . 64.0 110.726 176.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -86.4 75.06 9.84 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 123.816 0.846 . . . . 75.420000000000002 109.513 -179.274 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -64.52 -28.58 69.75 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 114.625 -1.17 . . . . 63.399999999999999 113.588 -172.038 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 43.7 t30 -60.69 -38.29 84.5 Favored 'General case' 0 N--CA 1.489 1.52 0 CA-C-N 118.584 0.629 . . . . 63.210000000000001 110.814 -179.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 78.5 mt -69.78 -38.5 76.73 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.421 0.688 . . . . 74.519999999999996 110.953 177.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.507 HG22 ' HG2' ' A' ' 65' ' ' GLN . 52.2 mt -62.65 -46.26 96.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.939 0.896 . . . . 50.329999999999998 110.246 175.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -58.86 -31.41 68.52 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 124.645 1.178 . . . . 63.229999999999997 111.692 178.688 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 54.4 m170 -70.36 -34.29 72.45 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.248 0.619 . . . . 74.409999999999997 111.463 177.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.506 ' HB2' HG12 ' A' ' 116' ' ' ILE . 39.2 t -113.17 105.04 12.97 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.479 0.712 . . . . 70.200000000000003 110.154 -175.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.1 tppt? -56.98 -31.89 65.51 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 123.414 0.686 . . . . 71.430000000000007 110.748 174.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.477 HD11 HD12 ' A' ' 105' ' ' LEU . 43.9 tp -63.14 -44.52 95.31 Favored 'General case' 0 C--N 1.348 0.538 0 C-N-CA 124.095 0.958 . . . . 71.439999999999998 110.535 177.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.59 -43.71 97.06 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 123.272 0.629 . . . . 71.019999999999996 110.698 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.507 ' HG2' HG22 ' A' ' 58' ' ' ILE . 68.9 mt-30 -56.93 -44.53 82.57 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 124.355 1.035 . . . . 71.239999999999995 110.846 177.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.409 HE21 ' NE2' ' A' ' 70' ' ' GLN . 18.8 mm100 -68.32 -36.78 79.81 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.434 0.693 . . . . 64.510000000000005 111.987 179.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 81.3 mt -68.72 -48.67 70.13 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.28 0.632 . . . . 64.400000000000006 111.027 -179.5 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -66.97 -30.6 70.77 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.693 0.397 . . . . 72.140000000000001 111.289 178.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 50.5 tp -72.37 -52.41 16.19 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.198 0.599 . . . . 55.340000000000003 111.291 179.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.409 ' NE2' HE21 ' A' ' 66' ' ' GLN . 78.6 mt-30 -85.02 -29.23 25.14 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 123.629 0.771 . . . . 75.349999999999994 111.937 -172.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 58.9 m -118.98 87.35 33.73 Favored Pre-proline 0 CA--C 1.544 0.749 0 N-CA-C 107.72 -1.215 . . . . 64.120000000000005 107.72 177.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -68.07 -17.77 45.78 Favored 'Trans proline' 0 C--N 1.373 1.845 0 C-N-CA 123.11 2.54 . . . . 75.409999999999997 113.456 -172.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -76.5 -12.89 83.96 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-O 119.14 -0.811 . . . . 43.409999999999997 114.364 -177.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.4 t -70.64 123.32 24.37 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 CA-C-N 117.491 0.646 . . . . 65.420000000000002 110.7 -175.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 29.9 mm-40 -81.22 -50.78 9.16 Favored 'General case' 0 C--O 1.24 0.579 0 C-N-CA 124.693 1.197 . . . . 74.219999999999999 110.168 179.362 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 56.7 p -157.62 163.65 38.05 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 114.637 -1.165 . . . . 72.340000000000003 110.911 -173.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.4 mt -119.27 164.94 14.9 Favored 'General case' 0 C--N 1.33 -0.279 0 C-N-CA 124.761 1.224 . . . . 71.140000000000001 108.533 177.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.56 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 56.0 ttm -138.33 108.43 6.4 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 107.982 -1.118 . . . . 73.230000000000004 107.982 166.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.75 HD13 HD13 ' A' ' 84' ' ' LEU . 23.0 mm -83.81 102.05 9.25 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 N-CA-C 108.465 -0.939 . . . . 70.239999999999995 108.465 -179.472 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.38 -173.69 48.43 Favored Glycine 0 C--O 1.241 0.574 0 N-CA-C 110.511 -1.036 . . . . 74.230000000000004 110.511 173.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -67.74 -63.49 1.05 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 109.159 -0.682 . . . . 71.439999999999998 109.159 178.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -95.57 -21.59 18.16 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.025 0.53 . . . . 64.420000000000002 111.563 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -120.13 169.68 10.01 Favored 'General case' 0 N--CA 1.482 1.15 0 N-CA-C 112.738 0.644 . . . . 73.409999999999997 112.738 -168.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.75 HD13 HD13 ' A' ' 79' ' ' ILE . 18.0 tp -142.79 117.64 9.92 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 125.164 1.386 . . . . 62.130000000000003 107.827 176.599 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.56 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 58.4 m -96.95 109.69 22.38 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 108.811 -0.811 . . . . 64.319999999999993 108.811 -177.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 25.8 mm -89.33 124.13 41.9 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 N-CA-C 108.448 -0.945 . . . . 64.0 108.448 179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.3 m-80 -109.86 127.95 55.03 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.394 -1.336 . . . . 64.299999999999997 107.394 175.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.505 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -130.8 172.29 12.17 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.79 0.436 . . . . 74.319999999999993 110.093 -176.874 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.407 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 12.5 t70 -81.44 141.94 33.42 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 109.01 -0.737 . . . . 74.150000000000006 109.01 172.29 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.7 ptp180 -66.35 -10.88 47.44 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 113.581 0.956 . . . . 72.049999999999997 113.581 -172.343 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . 0.435 ' HG3' HG23 ' A' ' 92' ' ' VAL . 24.1 ptm -76.04 -28.04 57.52 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.174 0.443 . . . . 54.310000000000002 111.144 175.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.435 HG23 ' HG3' ' A' ' 91' ' ' MET . 40.9 t -99.1 127.29 51.92 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 109.051 -0.722 . . . . 74.409999999999997 109.051 -175.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -95.3 154.12 17.35 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 123.35 0.66 . . . . 73.310000000000002 111.129 -173.016 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.505 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 97.2 m95 -68.04 -13.78 62.46 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 124.19 0.996 . . . . 72.409999999999997 112.598 -178.74 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 17.0 m120 -52.5 -35.0 52.02 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.115 0.966 . . . . 73.340000000000003 111.876 175.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 20.4 t -97.26 -32.79 11.73 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.315 0.646 . . . . 74.140000000000001 110.826 -177.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 65.1 mt -80.55 -51.27 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 C-N-CA 123.509 0.724 . . . . 55.229999999999997 110.857 -166.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.468 ' HG3' ' HB3' ' A' ' 94' ' ' TRP . 59.8 mtpt -54.85 -58.45 14.46 Favored Pre-proline 0 N--CA 1.484 1.246 0 CA-C-O 117.583 -1.199 . . . . 74.310000000000002 113.064 -174.034 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 31.1 Cg_endo -59.73 -36.25 92.24 Favored 'Trans proline' 0 C--N 1.398 3.135 0 C-N-CA 121.804 1.669 . . . . 33.210000000000001 112.203 -171.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.414 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 53.5 mt-10 -64.91 -46.43 81.74 Favored 'General case' 0 C--N 1.35 0.598 0 O-C-N 123.96 0.788 . . . . 64.519999999999996 110.272 177.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 37.7 mt -70.33 -32.18 49.51 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 C-N-CA 123.456 0.703 . . . . 73.5 111.888 -178.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 98' ' ' LYS . 45.0 mm -62.99 -44.0 99.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.229 0 N-CA-C 109.165 -0.68 . . . . 72.230000000000004 109.165 175.036 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -61.56 -50.94 70.63 Favored 'General case' 0 C--N 1.354 0.783 0 CA-C-N 114.989 -1.005 . . . . 74.340000000000003 110.421 177.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 96.0 mt -61.85 -39.68 92.7 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.095 0.958 . . . . 71.329999999999998 111.567 -177.039 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.477 HD12 HD11 ' A' ' 63' ' ' LEU . 7.6 mp -64.73 -37.39 87.45 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.297 0.639 . . . . 74.129999999999995 110.812 176.569 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.433 HG23 ' H ' ' A' ' 17' ' ' ILE . 85.4 m -71.8 -34.09 69.08 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 122.812 0.445 . . . . 73.340000000000003 109.978 -179.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm -67.41 -47.49 70.13 Favored 'General case' 0 C--N 1.356 0.859 0 C-N-CA 123.515 0.726 . . . . 75.420000000000002 109.994 176.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -61.95 -48.24 81.29 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 124.22 0.95 . . . . 73.329999999999998 109.995 -175.356 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.425 ' HB3' ' HB2' ' A' ' 38' ' ' GLU . 67.3 mt -68.2 -14.24 62.83 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.916 0.76 . . . . 74.340000000000003 112.19 179.341 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -89.46 -22.15 22.63 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.542 0.737 . . . . 71.200000000000003 111.379 174.388 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.4 m-85 -90.51 -51.98 5.13 Favored 'General case' 0 N--CA 1.482 1.143 0 CA-C-O 121.229 0.538 . . . . 75.150000000000006 110.554 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -142.5 146.98 18.31 Favored Glycine 0 C--N 1.343 0.954 0 CA-C-N 114.974 -1.012 . . . . 62.350000000000001 111.835 -175.707 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -77.64 -34.58 53.14 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.591 0.756 . . . . 74.150000000000006 111.026 -174.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -97.7 138.82 34.5 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.002 0.521 . . . . 62.299999999999997 109.667 170.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.576 HG13 HG13 ' A' ' 116' ' ' ILE . 3.7 p -67.53 -42.75 87.23 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 123.781 0.832 . . . . 74.340000000000003 111.304 -178.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.576 HG13 HG13 ' A' ' 115' ' ' VAL . 54.0 mt -117.54 135.29 58.41 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 C-N-CA 123.268 0.627 . . . . 74.319999999999993 109.451 -175.773 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 50.3 m -62.71 109.07 1.3 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 106.465 -1.68 . . . . 71.109999999999999 106.465 163.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -53.69 88.63 0.01 OUTLIER 'General case' 0 CA--C 1.551 1.012 0 N-CA-C 114.262 1.208 . . . . 72.540000000000006 114.262 -154.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 . . . . . 0 CA--C 1.56 1.337 0 C-N-CA 125.688 1.595 . . . . 74.430000000000007 112.131 170.248 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.486 1.356 0 N-CA-C 110.275 -0.268 . . . . 72.129999999999995 110.275 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -150.91 131.34 3.49 Favored Glycine 0 C--N 1.349 1.262 0 N-CA-C 111.799 -0.52 . . . . 73.519999999999996 111.799 -178.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 60.3 m-70 -128.94 80.33 1.96 Allowed 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 108.088 -1.078 . . . . 74.319999999999993 108.088 175.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -83.96 109.93 18.01 Favored 'General case' 0 N--CA 1.473 0.709 0 CA-C-N 115.584 -0.735 . . . . 74.409999999999997 109.9 179.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.8 p80 -150.92 84.35 1.34 Allowed 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.587 0.755 . . . . 72.310000000000002 110.04 177.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 11.9 t-80 -161.59 87.65 0.69 Allowed 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.28 -0.873 . . . . 72.430000000000007 109.432 174.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 13.4 p80 -124.45 98.17 5.63 Favored 'General case' 0 CA--C 1.542 0.658 0 N-CA-C 108.426 -0.953 . . . . 72.219999999999999 108.426 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -107.18 114.0 27.77 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.552 0.741 . . . . 74.109999999999999 109.867 -177.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 17.8 t -121.86 163.38 19.31 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 123.575 0.75 . . . . 31.329999999999998 109.501 175.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.0 p-80 -149.78 147.63 28.24 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 109.218 -0.66 . . . . 72.209999999999994 109.218 177.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 41.8 tpp -160.94 119.99 2.58 Favored 'General case' 0 N--CA 1.471 0.583 0 CA-C-O 121.291 0.567 . . . . 63.119999999999997 110.622 177.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -129.36 99.35 5.17 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 106.214 -1.772 . . . . 64.219999999999999 106.214 168.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.8 t -122.49 45.86 2.27 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 108.017 -1.105 . . . . 72.0 108.017 179.395 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 87.1 mm-40 -84.2 33.32 0.5 Allowed 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 114.789 -1.096 . . . . 74.219999999999999 112.758 -174.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.51 117.61 10.49 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 108.166 -1.05 . . . . 74.519999999999996 108.166 165.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -66.44 143.44 57.11 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 109.431 -0.581 . . . . 73.239999999999995 109.431 173.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 57.1 mt -95.65 115.9 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 O-C-N 123.569 0.543 . . . . 73.400000000000006 111.608 -162.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 10.3 m-70 -95.2 145.73 24.83 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.674 0.79 . . . . 73.129999999999995 109.018 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.0 mm -129.03 126.78 65.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 106.75 -1.574 . . . . 74.450000000000003 106.75 -176.092 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -105.75 125.73 51.33 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.311 -0.996 . . . . 51.409999999999997 108.311 -179.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.9 t -102.57 113.15 26.27 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 109.101 -0.704 . . . . 61.109999999999999 109.101 -177.594 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 84.8 mt -101.3 140.55 35.44 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.579 0.752 . . . . 44.119999999999997 110.321 177.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 28.0 p -85.34 157.69 20.47 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.005 0.522 . . . . 74.439999999999998 111.211 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 80.3 p -126.72 161.48 52.86 Favored Pre-proline 0 CA--C 1.558 1.283 0 C-N-CA 124.762 1.225 . . . . 65.430000000000007 108.305 -177.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -61.53 -17.92 56.74 Favored 'Trans proline' 0 C--N 1.383 2.364 0 C-N-CA 122.23 1.953 . . . . 62.039999999999999 113.526 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 44.8 t-20 -101.29 132.41 46.83 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 108.684 -0.858 . . . . 61.219999999999999 108.684 175.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -79.09 -16.6 56.52 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.563 0.345 . . . . 61.140000000000001 111.918 -176.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.407 ' N ' HD22 ' A' ' 28' ' ' ASN . 0.7 OUTLIER -70.6 -38.75 74.04 Favored 'General case' 0 N--CA 1.48 1.05 0 N-CA-C 109.41 -0.589 . . . . 72.030000000000001 109.41 175.044 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.48 144.62 26.63 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.499 0.72 . . . . 74.120000000000005 110.67 -178.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.5 tp -154.94 124.29 6.38 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 109.211 -0.663 . . . . 74.010000000000005 109.211 174.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 37.5 ttmt -83.63 121.37 27.16 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.766 0.826 . . . . 63.240000000000002 110.837 -175.407 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -109.4 112.73 25.02 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.299 1.04 . . . . 74.420000000000002 108.468 168.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.2 tp -105.01 134.48 48.04 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.27 1.028 . . . . 55.020000000000003 109.352 -176.28 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.4 p -74.91 105.25 5.85 Favored 'General case' 0 CA--C 1.549 0.942 0 N-CA-C 108.54 -0.911 . . . . 71.140000000000001 108.54 172.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 6.6 m -107.97 39.97 1.84 Allowed 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 124.473 1.109 . . . . 74.209999999999994 110.025 -168.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -137.16 -156.14 0.67 Allowed 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.043 -0.98 . . . . 63.140000000000001 108.548 -178.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -72.87 -20.62 79.91 Favored Glycine 0 C--N 1.352 1.423 0 CA-C-N 118.295 0.498 . . . . 70.409999999999997 113.352 178.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.1 mm-40 -94.76 158.7 15.39 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-O 121.31 0.576 . . . . 55.299999999999997 111.633 -176.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 27.5 ttt -134.25 150.97 51.06 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.604 1.162 . . . . 74.150000000000006 109.128 -175.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.546 ' O ' ' HB3' ' A' ' 114' ' ' ASP . 94.1 mt -78.77 -58.07 3.43 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 112.86 0.689 . . . . 63.119999999999997 112.86 -175.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 9.2 tp-100 -116.28 -106.11 0.39 Allowed 'General case' 0 N--CA 1.48 1.07 0 O-C-N 121.591 -0.693 . . . . 72.340000000000003 109.731 -177.352 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 10.7 t -169.64 143.64 2.76 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 108.704 -0.85 . . . . 62.329999999999998 108.704 -176.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 2.1 tmm_? -70.43 114.26 8.37 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 107.948 -1.13 . . . . 65.120000000000005 107.948 -177.4 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.92 63.52 1.05 Allowed Glycine 0 C--N 1.336 0.533 0 N-CA-C 110.499 -1.04 . . . . 74.450000000000003 110.499 -175.457 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 11.4 t -136.21 -171.94 3.01 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.086 0.554 . . . . 74.120000000000005 109.822 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 2.5 mppt? -93.35 142.59 27.15 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.073 0.949 . . . . 52.340000000000003 108.669 -178.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 20.4 m -79.36 83.28 5.41 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 108.726 -0.842 . . . . 71.400000000000006 108.726 172.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 52.5 mt -73.93 99.58 1.28 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.068 0 CA-C-N 115.536 -0.756 . . . . 71.540000000000006 109.956 -170.554 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 77' ' ' LEU . 40.0 t -96.31 107.61 20.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 N-CA-C 108.907 -0.775 . . . . 72.040000000000006 108.907 -179.727 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.42 HG23 ' HB2' ' A' ' 57' ' ' LEU . 71.9 mt -105.18 113.46 42.25 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.405 0 C-N-CA 124.436 1.094 . . . . 64.540000000000006 108.401 -179.667 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.6 mtmp? -80.2 161.53 25.15 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 108.862 -0.792 . . . . 72.409999999999997 108.862 176.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.2 p30 -64.09 -18.38 64.34 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.668 0.787 . . . . 74.310000000000002 111.935 178.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 74.1 p -74.9 -27.77 60.36 Favored 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 124.52 1.128 . . . . 65.400000000000006 112.08 175.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.89 69.35 10.55 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.792 0.837 . . . . 61.140000000000001 111.225 -172.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -60.12 -29.62 68.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.416 0.686 . . . . 74.230000000000004 111.609 -177.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.1 t30 -58.3 -48.46 80.44 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.684 1.194 . . . . 70.439999999999998 110.932 175.595 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.42 ' HB2' HG23 ' A' ' 50' ' ' ILE . 89.8 mt -79.05 -29.97 43.8 Favored 'General case' 0 CA--C 1.555 1.143 0 CA-C-N 115.517 -0.765 . . . . 72.239999999999995 111.227 -177.576 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 93.5 mt -65.84 -43.48 93.14 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.273 0 C-N-CA 123.874 0.869 . . . . 71.25 109.859 176.184 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.432 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 90.2 m-20 -69.96 -7.72 43.02 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 112.882 0.697 . . . . 62.520000000000003 112.882 178.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 10.1 t-80 -91.89 -6.12 52.03 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 122.873 0.469 . . . . 73.430000000000007 110.946 174.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.509 ' HB3' HG12 ' A' ' 116' ' ' ILE . 19.3 p -140.2 104.78 4.89 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 123.748 0.819 . . . . 70.450000000000003 109.596 -179.68 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.477 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 38.6 ttpt -56.69 -29.37 62.3 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.898 0.479 . . . . 74.109999999999999 111.461 178.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.525 HD11 HD12 ' A' ' 105' ' ' LEU . 25.5 tp -59.19 -46.62 87.95 Favored 'General case' 0 C--N 1.353 0.76 0 C-N-CA 123.292 0.637 . . . . 64.510000000000005 110.522 178.414 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.53 -47.16 86.61 Favored 'General case' 0 C--N 1.348 0.5 0 O-C-N 124.242 0.964 . . . . 73.239999999999995 110.375 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.432 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 97.6 mt-30 -54.4 -46.74 73.2 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 124.461 1.101 . . . . 75.549999999999997 111.57 179.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.477 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 15.0 mm100 -73.58 -35.26 65.42 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 116.043 -0.526 . . . . 74.299999999999997 112.027 -177.785 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 65.8 mt -65.45 -46.47 89.92 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 C-N-CA 122.983 0.513 . . . . 74.420000000000002 110.319 177.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 53.4 m-85 -70.08 -28.7 65.64 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.054 0.542 . . . . 73.040000000000006 111.71 178.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.5 tp -69.63 -55.99 8.52 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 122.727 0.411 . . . . 75.150000000000006 110.278 175.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.452 HE22 HD21 ' A' ' 104' ' ' LEU . 78.1 mt-30 -70.6 -26.81 63.67 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 115.367 -0.833 . . . . 41.240000000000002 110.949 -175.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.717 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 77.6 m -144.25 91.91 6.29 Favored Pre-proline 0 CA--C 1.547 0.862 0 C-N-CA 123.334 0.654 . . . . 54.439999999999998 109.932 178.295 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.58 3.01 5.18 Favored 'Trans proline' 0 C--N 1.37 1.682 0 C-N-CA 122.97 2.447 . . . . 50.109999999999999 113.691 176.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -94.26 22.49 36.58 Favored Glycine 0 C--N 1.347 1.16 0 C-N-CA 122.82 0.248 . . . . 60.43 113.244 175.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.428 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 60.5 t -98.75 132.24 44.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.494 0.718 . . . . 72.530000000000001 109.707 172.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mm-40 -88.61 -48.17 7.75 Favored 'General case' 0 N--CA 1.488 1.446 0 C-N-CA 124.124 0.969 . . . . 71.230000000000004 112.602 -176.359 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 53.9 p -159.25 163.24 36.02 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 122.859 0.464 . . . . 73.319999999999993 111.509 -177.158 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.404 ' O ' ' HA ' ' A' ' 49' ' ' VAL . 42.3 mt -124.88 125.59 44.21 Favored 'General case' 0 C--O 1.219 -0.528 0 N-CA-C 107.983 -1.117 . . . . 63.119999999999997 107.983 179.405 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.499 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.9 ttm -105.47 112.68 25.86 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 107.657 -1.238 . . . . 63.409999999999997 107.657 174.826 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.509 HD12 HG21 ' A' ' 115' ' ' VAL . 18.9 mm -86.71 113.5 24.53 Favored 'Isoleucine or valine' 0 C--O 1.239 0.548 0 N-CA-C 107.956 -1.127 . . . . 74.439999999999998 107.956 178.884 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -84.12 -171.45 47.9 Favored Glycine 0 C--O 1.243 0.663 0 N-CA-C 111.373 -0.691 . . . . 65.140000000000001 111.373 174.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -70.12 -60.57 2.21 Favored 'General case' 0 N--CA 1.475 0.824 0 N-CA-C 109.381 -0.599 . . . . 72.439999999999998 109.381 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -96.67 -37.09 10.47 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.587 1.155 . . . . 74.329999999999998 109.989 178.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 25.1 p90 -102.92 175.87 5.34 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 114.512 -1.222 . . . . 75.109999999999999 112.529 -165.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.406 HD21 HD11 ' A' ' 86' ' ' ILE . 29.2 tp -129.57 146.6 51.37 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 106.69 -1.596 . . . . 54.009999999999998 106.69 173.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.499 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 89.9 m -130.01 110.1 11.38 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 108.476 -0.935 . . . . 61.130000000000003 108.476 174.399 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.549 HG13 HD13 ' A' ' 101' ' ' ILE . 22.5 mm -88.56 118.18 33.53 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.234 0 N-CA-C 108.653 -0.869 . . . . 51.299999999999997 108.653 179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -96.28 116.92 29.79 Favored 'General case' 0 N--CA 1.464 0.266 0 N-CA-C 107.9 -1.148 . . . . 65.109999999999999 107.9 172.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.428 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 19.5 pttp -104.58 175.02 5.63 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.527 0.731 . . . . 71.540000000000006 109.354 -178.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -74.74 137.52 42.09 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 115.154 -0.93 . . . . 75.299999999999997 108.732 168.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.87 -36.38 74.53 Favored 'General case' 0 N--CA 1.48 1.067 0 C-N-CA 125.21 1.404 . . . . 74.310000000000002 113.002 -176.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 66.3 mtt -83.83 -15.17 49.28 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.565 0.746 . . . . 61.329999999999998 111.431 -177.713 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 57.9 t -88.33 144.76 8.49 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 N-CA-C 109.323 -0.621 . . . . 74.219999999999999 109.323 175.546 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 11.7 t-80 -105.11 144.56 31.74 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.101 0.961 . . . . 74.140000000000001 110.556 -171.526 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 53.1 m95 -66.98 -23.79 65.98 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 114.069 1.137 . . . . 73.109999999999999 114.069 -175.448 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -61.48 -21.34 64.1 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.123 0.569 . . . . 64.540000000000006 112.0 -172.642 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -92.88 -33.78 14.08 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.393 0.677 . . . . 71.109999999999999 111.71 174.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.717 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 34.6 mt -83.44 -47.29 18.21 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.183 0 C-N-CA 123.245 0.618 . . . . 63.420000000000002 111.315 -166.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -53.83 -53.23 60.13 Favored Pre-proline 0 N--CA 1.486 1.355 0 CA-C-O 117.651 -1.166 . . . . 54.299999999999997 114.015 -175.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -56.87 -37.93 97.07 Favored 'Trans proline' 0 C--N 1.399 3.231 0 C-N-CA 122.142 1.895 . . . . 73.150000000000006 111.701 -176.477 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -61.45 -53.78 52.09 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.033 -0.985 . . . . 40.240000000000002 110.396 179.147 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.549 HD13 HG13 ' A' ' 86' ' ' ILE . 65.0 mt -61.42 -51.94 67.08 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.904 0 O-C-N 124.132 0.895 . . . . 75.209999999999994 111.917 -178.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 98.0 mt -56.45 -43.61 78.26 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 C-N-CA 123.757 0.823 . . . . 74.219999999999999 111.483 -177.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -59.25 -48.99 79.57 Favored 'General case' 0 CA--C 1.548 0.898 0 O-C-N 123.906 0.754 . . . . 51.539999999999999 110.067 177.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.452 HD21 HE22 ' A' ' 70' ' ' GLN . 84.3 mt -58.39 -44.54 88.97 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-N 114.656 -1.157 . . . . 72.420000000000002 112.087 -179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.525 HD12 HD11 ' A' ' 63' ' ' LEU . 10.2 mp -65.84 -33.66 76.35 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 123.571 0.748 . . . . 62.399999999999999 111.755 -178.188 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 60.9 m -75.84 -34.68 60.08 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.219 0.608 . . . . 61.450000000000003 110.383 -176.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.8 mmtm -75.19 -48.55 23.02 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.077 0.551 . . . . 73.439999999999998 110.177 178.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.517 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 23.6 tt0 -51.18 -59.9 3.69 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 125.586 1.554 . . . . 75.349999999999994 112.483 -176.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 93.4 mt -63.41 -26.88 68.94 Favored 'General case' 0 CA--C 1.551 0.983 0 CA-C-N 114.761 -1.108 . . . . 73.430000000000007 110.97 -177.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.98 -10.12 59.35 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.917 0.887 . . . . 65.239999999999995 112.268 -178.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 25.9 m-85 -81.46 -15.18 55.81 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 122.61 0.364 . . . . 65.340000000000003 110.764 169.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 113.88 -28.7 8.27 Favored Glycine 0 C--N 1.346 1.119 0 CA-C-N 116.135 -0.484 . . . . 42.229999999999997 112.101 178.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 67.1 mm-40 -90.42 178.67 6.06 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.621 0.769 . . . . 51.420000000000002 112.724 -177.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.546 ' HB3' ' O ' ' A' ' 40' ' ' LEU . 6.2 m-20 -110.23 -170.64 1.68 Allowed 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.424 -1.262 . . . . 54.329999999999998 111.453 -170.237 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.509 HG21 HD12 ' A' ' 79' ' ' ILE . 7.2 p -57.97 -44.53 86.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.045 0 C-N-CA 124.316 1.047 . . . . 64.120000000000005 112.196 178.401 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.509 HG12 ' HB3' ' A' ' 61' ' ' SER . 35.3 mt -133.13 152.45 35.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 124.68 1.192 . . . . 44.109999999999999 108.1 -179.491 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 18.8 m -66.96 89.74 0.17 Allowed 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 109.195 -0.669 . . . . 75.519999999999996 109.195 171.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.512 ' H ' ' HD3' ' A' ' 118' ' ' LYS . 0.0 OUTLIER -68.86 93.31 0.54 Allowed 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.077 0.951 . . . . 53.310000000000002 110.718 -178.533 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 . . . . . 0 C--O 1.251 1.138 0 N-CA-C 108.728 -0.841 . . . . 65.349999999999994 108.728 -178.959 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 70.3 mtm . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 110.355 -0.239 . . . . 72.239999999999995 110.355 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 128.0 -84.67 0.33 Allowed Glycine 0 C--N 1.348 1.208 0 N-CA-C 111.196 -0.762 . . . . 71.329999999999998 111.196 176.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 24.6 t60 -141.94 135.25 29.21 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.892 0.877 . . . . 70.430000000000007 109.119 179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -74.32 -78.21 0.1 Allowed 'General case' 0 CA--C 1.553 1.073 0 C-N-CA 123.298 0.639 . . . . 54.240000000000002 112.082 -176.172 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 29.4 m170 -141.0 171.84 13.5 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 123.839 0.856 . . . . 72.129999999999995 111.091 -172.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 28.8 t-80 -93.98 142.07 27.8 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.75 0.82 . . . . 61.229999999999997 110.745 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 53.6 t-80 -71.97 135.13 46.33 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.612 0.765 . . . . 73.340000000000003 110.388 177.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 31.7 m-70 -93.0 101.14 13.48 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 123.482 0.713 . . . . 72.019999999999996 109.082 176.434 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 41.6 m -91.58 117.78 30.03 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.123 0.569 . . . . 61.439999999999998 109.77 178.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 23.2 p80 -149.5 136.58 19.75 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.662 0.785 . . . . 75.0 109.786 -174.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.7 ttt -147.12 124.28 11.47 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.702 0.801 . . . . 70.099999999999994 109.739 -178.346 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 38.2 m-80 -137.32 142.13 41.86 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.05 0.94 . . . . 51.420000000000002 108.472 175.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 57.2 m -145.32 133.24 21.27 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.294 0.638 . . . . 65.120000000000005 109.815 177.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.475 HE21 HD22 ' A' ' 16' ' ' LEU . 57.4 tp60 -147.46 116.85 6.98 Favored 'General case' 0 C--O 1.241 0.622 0 C-N-CA 123.966 0.906 . . . . 63.439999999999998 108.655 178.509 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 13.4 ptt180 -131.17 132.5 44.78 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.682 0.793 . . . . 75.299999999999997 109.044 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.475 HD22 HE21 ' A' ' 14' ' ' GLN . 2.6 pt? -157.1 156.18 32.33 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.158 0.583 . . . . 70.25 109.936 -179.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 48.3 mm -69.31 107.77 1.63 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.797 0 N-CA-C 109.161 -0.681 . . . . 75.120000000000005 109.161 175.193 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 59.2 m80 -74.04 116.01 14.18 Favored 'General case' 0 C--O 1.241 0.638 0 C-N-CA 124.484 1.114 . . . . 60.32 110.196 -177.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.8 mm -122.98 114.46 42.24 Favored 'Isoleucine or valine' 0 C--O 1.245 0.827 0 N-CA-C 107.697 -1.223 . . . . 62.100000000000001 107.697 -179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 40.7 ttmt -98.94 131.35 45.07 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 123.473 0.709 . . . . 71.209999999999994 109.992 -177.2 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 28.7 m -93.55 114.01 26.26 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 108.969 -0.752 . . . . 74.450000000000003 108.969 -179.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 85.3 mt -121.14 137.61 54.59 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.859 0.864 . . . . 72.019999999999996 110.141 -175.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 47.2 p -85.73 153.83 22.05 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.876 0.87 . . . . 54.409999999999997 111.09 178.665 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.418 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 47.7 p -121.51 175.67 2.35 Favored Pre-proline 0 CA--C 1.56 1.35 0 N-CA-C 107.715 -1.217 . . . . 75.209999999999994 107.715 178.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.418 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 62.6 Cg_endo -71.76 2.76 4.36 Favored 'Trans proline' 0 C--N 1.377 2.057 0 C-N-CA 121.886 1.724 . . . . 72.540000000000006 113.061 167.42 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.562 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 91.2 m-20 -108.3 135.7 49.17 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.212 1.005 . . . . 75.109999999999999 111.501 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -72.02 -25.37 61.79 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 124.207 1.003 . . . . 73.430000000000007 111.623 174.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' ' HA ' ' A' ' 87' ' ' ASN . 86.7 m-20 -112.02 29.94 7.46 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.021 0.928 . . . . 52.399999999999999 110.553 -176.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.562 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -142.01 124.73 15.95 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.177 0.591 . . . . 40.399999999999999 109.634 172.341 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.1 tp -135.02 121.43 20.42 Favored 'General case' 0 N--CA 1.48 1.033 0 N-CA-C 108.609 -0.885 . . . . 74.519999999999996 108.609 178.488 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.532 ' HE2' HD13 ' A' ' 33' ' ' LEU . 87.8 tttt -87.61 119.43 27.91 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.181 0.992 . . . . 71.120000000000005 111.116 -175.155 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -103.8 111.21 23.63 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 107.818 -1.178 . . . . 71.409999999999997 107.818 173.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.532 HD13 ' HE2' ' A' ' 31' ' ' LYS . 37.8 tp -104.35 128.16 52.13 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 124.382 1.073 . . . . 61.210000000000001 110.185 -167.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 28.4 m -70.76 105.69 3.29 Favored 'General case' 0 CA--C 1.542 0.642 0 N-CA-C 107.753 -1.202 . . . . 73.400000000000006 107.753 170.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.0 m -86.87 -15.53 38.78 Favored 'General case' 0 CA--C 1.554 1.132 0 C-N-CA 122.858 0.463 . . . . 52.340000000000003 111.754 -168.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -93.58 -64.3 1.1 Allowed 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.531 0.733 . . . . 75.329999999999998 111.201 -178.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.418 ' O ' ' HG3' ' A' ' 39' ' ' MET . . . 156.08 -7.4 0.25 Allowed Glycine 0 C--N 1.341 0.847 0 CA-C-O 119.392 -0.671 . . . . 74.329999999999998 113.302 -174.281 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 109' ' ' LEU . 1.0 OUTLIER -71.07 104.72 3.11 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 108.158 -1.053 . . . . 73.310000000000002 108.158 168.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.418 ' HG3' ' O ' ' A' ' 37' ' ' GLY . 87.9 mtp -103.3 151.04 23.17 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.652 0.781 . . . . 74.420000000000002 110.605 -170.277 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.7 mt -71.4 -36.4 71.37 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.885 0.874 . . . . 63.229999999999997 112.008 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 22.1 mm-40 -129.64 -156.06 0.73 Allowed 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 123.515 0.726 . . . . 74.109999999999999 109.644 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 41.2 p -67.32 -146.76 0.01 OUTLIER 'General case' 0 CA--C 1.559 1.314 0 C-N-CA 124.052 0.941 . . . . 62.549999999999997 110.546 170.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 21.6 mtp180 -114.97 141.43 47.99 Favored 'General case' 0 N--CA 1.484 1.233 0 O-C-N 121.005 -1.06 . . . . 73.430000000000007 109.854 173.514 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 63.39 46.92 91.59 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 123.907 0.754 . . . . 64.329999999999998 112.5 -176.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 41.4 t -73.85 151.4 40.51 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.347 0.659 . . . . 72.400000000000006 111.0 -176.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 58.4 pttt -70.35 158.25 36.28 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 115.16 -0.927 . . . . 71.310000000000002 110.52 173.763 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 13.3 m -78.67 89.15 4.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.372 0.669 . . . . 70.219999999999999 109.431 -179.31 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.635 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 42.8 mt -77.21 100.42 2.71 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 108.852 -0.795 . . . . 71.329999999999998 108.852 -177.358 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.1 t -90.33 109.8 21.22 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.727 0 C-N-CA 123.549 0.74 . . . . 64.329999999999998 109.267 -175.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 81.4 mt -118.73 111.06 32.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 124.39 1.076 . . . . 63.539999999999999 108.575 -178.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.525 ' HG2' ' HB3' ' A' ' 76' ' ' SER . 94.9 mttt -88.03 159.36 18.3 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 109.666 -0.494 . . . . 74.010000000000005 109.666 176.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.8 p30 -64.83 -20.93 66.66 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 122.918 0.487 . . . . 73.530000000000001 110.934 176.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 22.9 p -78.61 -31.23 46.96 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 124.124 0.97 . . . . 70.200000000000003 110.985 176.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -76.48 74.31 3.22 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.584 0.754 . . . . 51.299999999999997 110.128 178.691 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -55.88 -43.53 77.26 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.926 0.89 . . . . 64.340000000000003 111.742 -175.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.4 t-20 -55.59 -48.31 75.05 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.09 0.956 . . . . 74.430000000000007 110.907 -177.484 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.3 mt -62.39 -36.05 81.09 Favored 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.102 -0.954 . . . . 71.140000000000001 111.052 -178.437 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 54.0 mt -73.51 -45.27 52.12 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.737 0 C-N-CA 123.183 0.593 . . . . 52.409999999999997 110.311 -177.855 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 79.9 m-20 -54.12 -30.87 50.49 Favored 'General case' 0 N--CA 1.495 1.788 0 C-N-CA 124.422 1.089 . . . . 73.5 111.791 -178.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 64.1 m80 -87.81 -44.66 10.95 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 123.666 0.787 . . . . 71.129999999999995 110.703 175.833 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.662 ' HA ' ' HA ' ' A' ' 116' ' ' ILE . 50.5 m -79.04 98.76 6.6 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.056 0.455 . . . . 73.400000000000006 111.376 -176.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.503 ' HB2' ' HD2' ' A' ' 118' ' ' LYS . 31.6 ttpt -46.55 -53.08 12.07 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.716 1.607 . . . . 73.420000000000002 113.63 178.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.451 ' HB3' HG23 ' A' ' 115' ' ' VAL . 30.5 tp -65.3 -34.85 79.31 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 122.976 0.51 . . . . 75.349999999999994 111.722 -178.875 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.15 -40.95 97.7 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 122.329 0.252 . . . . 74.409999999999997 110.527 177.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 68.7 mt-30 -56.07 -50.34 71.27 Favored 'General case' 0 N--CA 1.475 0.783 0 O-C-N 124.013 0.821 . . . . 75.420000000000002 110.305 176.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.3 mm-40 -60.83 -48.81 80.09 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.059 0.943 . . . . 74.010000000000005 113.127 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 81.8 mt -64.3 -51.16 71.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.266 0 C-N-CA 123.403 0.681 . . . . 53.119999999999997 111.293 -175.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.4 m-85 -67.23 -33.63 75.75 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.046 0.538 . . . . 74.150000000000006 111.193 -179.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.6 tp -59.81 -53.69 54.93 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.499 0.72 . . . . 74.040000000000006 110.794 176.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.504 ' NE2' HD21 ' A' ' 104' ' ' LEU . 74.1 mt-30 -77.45 -24.55 50.28 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 114.978 -1.01 . . . . 74.319999999999993 112.498 -175.044 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.564 ' SG ' HG23 ' A' ' 97' ' ' ILE . 72.7 m -144.84 96.91 4.99 Favored Pre-proline 0 CA--C 1.549 0.916 0 N-CA-C 109.35 -0.611 . . . . 72.109999999999999 109.35 -178.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.4 0.27 10.08 Favored 'Trans proline' 0 C--N 1.376 2.015 0 C-N-CA 122.827 2.352 . . . . 73.120000000000005 113.132 178.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -84.68 -0.54 89.22 Favored Glycine 0 C--N 1.353 1.503 0 CA-C-O 119.89 -0.394 . . . . 74.230000000000004 113.023 176.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.0 t -82.22 123.76 38.54 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.237 0.615 . . . . 52.539999999999999 109.599 176.244 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.1 mm-40 -77.79 -55.0 5.69 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.932 0.893 . . . . 75.409999999999997 110.601 -178.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.525 ' HB3' ' HG2' ' A' ' 51' ' ' LYS . 27.7 p -150.14 164.03 36.67 Favored 'General case' 0 N--CA 1.471 0.616 0 CA-C-O 121.577 0.703 . . . . 74.409999999999997 111.459 -175.003 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 78.6 mt -122.57 128.66 51.02 Favored 'General case' 0 N--CA 1.465 0.282 0 C-N-CA 124.427 1.091 . . . . 73.420000000000002 108.265 178.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.538 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.4 ttm -102.25 99.12 9.19 Favored 'General case' 0 C--O 1.242 0.702 0 N-CA-C 106.741 -1.577 . . . . 75.409999999999997 106.741 169.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.635 ' HB ' ' HB ' ' A' ' 48' ' ' ILE . 29.1 mm -80.87 125.22 39.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.24 -1.022 . . . . 72.299999999999997 108.24 -177.836 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.52 -173.18 20.8 Favored Glycine 0 C--O 1.242 0.6 0 N-CA-C 111.539 -0.625 . . . . 73.310000000000002 111.539 172.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -80.06 -58.18 3.28 Favored 'General case' 0 N--CA 1.469 0.496 0 C-N-CA 122.807 0.443 . . . . 71.239999999999995 110.453 176.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -113.79 18.51 17.35 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 122.877 0.471 . . . . 71.409999999999997 110.92 179.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 26.5 p90 -148.5 163.61 36.66 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 122.755 0.422 . . . . 73.140000000000001 110.944 -177.232 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 51.8 tp -144.94 107.05 4.32 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.472 0.709 . . . . 74.219999999999999 109.243 178.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.538 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 28.0 m -96.95 106.74 19.13 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.299 -1.0 . . . . 75.129999999999995 108.299 -179.097 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.653 HG13 HD13 ' A' ' 101' ' ' ILE . 21.8 mm -87.47 141.53 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 123.518 0.727 . . . . 51.140000000000001 109.291 -175.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.455 ' HA ' ' O ' ' A' ' 28' ' ' ASN . 24.2 m-80 -120.82 120.63 36.13 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.802 0.841 . . . . 74.510000000000005 109.06 176.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.409 ' HD3' ' HB ' ' A' ' 92' ' ' VAL . 0.1 OUTLIER -122.01 165.94 15.25 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.719 0.808 . . . . 70.540000000000006 110.191 179.353 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -68.0 141.45 56.24 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.696 0.798 . . . . 62.299999999999997 109.382 175.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . 0.444 ' HB3' HD21 ' A' ' 28' ' ' ASN . 2.2 ptm180 -68.63 -10.98 59.43 Favored 'General case' 0 CA--C 1.551 1.009 0 N-CA-C 112.855 0.687 . . . . 73.530000000000001 112.855 -171.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.3 ptp -77.95 -16.13 58.42 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 123.011 0.525 . . . . 71.349999999999994 111.133 174.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.542 HG11 HD11 ' A' ' 97' ' ' ILE . 34.4 t -93.54 141.98 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.148 0.979 . . . . 75.25 110.262 -176.697 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . 0.528 ' HD2' ' H ' ' A' ' 95' ' ' ASN . 4.8 t60 -95.17 136.23 35.77 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.922 0.889 . . . . 65.25 108.881 176.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 44.9 m95 -58.66 -43.55 89.89 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 113.611 0.967 . . . . 74.510000000000005 113.611 -174.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . 0.528 ' H ' ' HD2' ' A' ' 93' ' ' HIS . 9.8 t30 -57.82 -18.58 22.96 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.469 0.707 . . . . 63.140000000000001 112.717 -174.678 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 19.4 m -69.21 -54.27 15.63 Favored 'General case' 0 CA--C 1.548 0.903 0 CA-C-O 121.386 0.613 . . . . 73.099999999999994 110.628 174.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.564 HG23 ' SG ' ' A' ' 71' ' ' CYS . 16.4 mt -83.96 -32.97 8.87 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.147 0 C-N-CA 123.913 0.885 . . . . 75.299999999999997 110.858 -171.75 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.8 ttpt -50.35 -56.08 20.95 Favored Pre-proline 0 CA--C 1.567 1.611 0 C-N-CA 125.038 1.335 . . . . 72.409999999999997 114.219 -172.134 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -67.58 -27.59 38.82 Favored 'Trans proline' 0 C--N 1.393 2.869 0 C-N-CA 121.8 1.666 . . . . 53.229999999999997 111.961 -176.305 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -67.78 -43.38 79.92 Favored 'General case' 0 C--N 1.349 0.568 0 C-N-CA 123.517 0.727 . . . . 71.329999999999998 109.746 177.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.653 HD13 HG13 ' A' ' 86' ' ' ILE . 95.6 mt -60.01 -51.16 76.15 Favored 'Isoleucine or valine' 0 C--N 1.359 0.998 0 C-N-CA 123.865 0.866 . . . . 71.019999999999996 109.784 176.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 74.0 mt -56.47 -41.04 71.28 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 123.522 0.729 . . . . 74.329999999999998 110.797 -178.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -65.75 -46.8 77.47 Favored 'General case' 0 CA--C 1.549 0.939 0 O-C-N 123.694 0.621 . . . . 55.109999999999999 110.933 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.504 HD21 ' NE2' ' A' ' 70' ' ' GLN . 99.0 mt -63.97 -35.07 79.48 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.958 0.903 . . . . 71.420000000000002 111.852 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.408 HD13 ' O ' ' A' ' 101' ' ' ILE . 8.6 mp -72.93 -23.72 60.72 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.83 0.852 . . . . 61.240000000000002 110.793 177.118 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 64.3 m -77.41 -36.59 53.17 Favored 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 109.183 -0.673 . . . . 75.019999999999996 109.183 174.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 1.5 mmmp? -66.42 -39.29 88.88 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.341 0.656 . . . . 73.010000000000005 110.296 175.79 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.409 HE22 ' HE3' ' A' ' 62' ' ' LYS . 11.7 mm100 -60.19 -63.68 1.22 Allowed 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.561 0.745 . . . . 73.450000000000003 110.714 176.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.483 ' HB3' ' HB3' ' A' ' 38' ' ' GLU . 74.2 mt -78.55 -2.83 40.7 Favored 'General case' 0 CA--C 1.549 0.928 0 CA-C-N 114.854 -1.066 . . . . 74.230000000000004 112.377 -167.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -89.71 -49.03 6.88 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.531 0.732 . . . . 73.349999999999994 111.266 171.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -88.88 -52.35 5.15 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-N 116.129 -0.487 . . . . 72.140000000000001 110.78 -171.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -158.67 103.57 0.23 Allowed Glycine 0 C--N 1.342 0.884 0 N-CA-C 109.867 -1.293 . . . . 61.329999999999998 109.867 -175.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -59.99 -24.95 64.87 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.908 1.283 . . . . 72.510000000000005 112.778 -164.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.9 t70 -68.05 118.28 11.01 Favored 'General case' 0 CA--C 1.545 0.773 0 O-C-N 123.688 0.618 . . . . 73.340000000000003 109.96 -176.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.712 HG13 HG13 ' A' ' 116' ' ' ILE . 3.5 p -55.85 -42.71 71.68 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.94 0 C-N-CA 125.625 1.57 . . . . 75.409999999999997 112.74 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.712 HG13 HG13 ' A' ' 115' ' ' VAL . 67.5 mt -92.94 -59.54 2.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 123.528 0.731 . . . . 53.020000000000003 109.839 -173.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 31.0 m -76.43 142.94 40.89 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 121.72 0.771 . . . . 42.439999999999998 112.543 -171.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.503 ' HD2' ' HB2' ' A' ' 62' ' ' LYS . 0.0 OUTLIER -142.3 37.18 1.53 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.443 1.497 . . . . 72.200000000000003 107.961 176.124 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 15.6 tp10 . . . . . 0 CA--C 1.555 1.155 0 CA-C-N 114.202 -1.363 . . . . 75.340000000000003 109.872 -177.677 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.455 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 mpt? . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 108.748 -0.834 . . . . 73.239999999999995 108.748 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.62 142.04 39.7 Favored Glycine 0 C--N 1.35 1.322 0 O-C-N 123.858 0.723 . . . . 52.399999999999999 113.719 -176.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 84.5 m-70 -125.96 134.89 51.38 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.874 0.87 . . . . 75.329999999999998 109.5 177.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 2.8 p80 -150.08 145.68 26.5 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.081 0.953 . . . . 73.329999999999998 109.374 178.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 68.4 m80 -132.12 152.9 50.98 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.455 0.702 . . . . 63.399999999999999 109.243 -177.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 30.8 m80 -84.98 126.63 33.69 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 110.158 -0.312 . . . . 71.030000000000001 110.158 176.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -75.36 123.89 26.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 123.71 0.804 . . . . 73.319999999999993 109.923 178.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 74.6 m80 -88.88 118.09 28.35 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.98 0.912 . . . . 55.32 109.88 176.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 43.0 m -94.78 156.81 16.22 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.481 0.712 . . . . 65.299999999999997 110.272 178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.7 t-80 -66.18 97.7 0.4 Allowed 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.173 -0.677 . . . . 71.200000000000003 109.173 173.177 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 88.2 mtp -80.71 99.8 8.39 Favored 'General case' 0 CA--C 1.536 0.439 0 N-CA-C 108.574 -0.899 . . . . 71.150000000000006 108.574 177.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.6 p30 -77.53 145.91 36.67 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.423 0.689 . . . . 73.340000000000003 111.229 -171.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.9 t -99.61 90.94 4.66 Favored 'General case' 0 CA--C 1.531 0.226 0 N-CA-C 107.859 -1.163 . . . . 54.219999999999999 107.859 174.684 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 -65.59 91.99 0.14 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 121.282 0.563 . . . . 74.140000000000001 110.322 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 62.5 mtp180 -133.21 70.71 1.46 Allowed 'General case' 0 C--O 1.242 0.671 0 C-N-CA 124.204 1.002 . . . . 74.5 108.798 177.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -151.15 149.04 29.0 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 123.806 0.842 . . . . 53.32 109.099 179.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.421 ' HB ' HG23 ' A' ' 106' ' ' THR . 77.0 mt -83.24 96.1 3.87 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 108.067 -1.086 . . . . 65.409999999999997 108.067 173.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.469 ' HB3' ' HB3' ' A' ' 36' ' ' ASP . 62.7 t60 -69.23 122.14 18.23 Favored 'General case' 0 CA--C 1.547 0.849 0 CA-C-N 113.829 -1.532 . . . . 72.349999999999994 111.707 -170.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 47.9 mm -126.34 125.55 67.72 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 107.239 -1.393 . . . . 70.109999999999999 107.239 -175.24 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.416 ' HE2' HD23 ' A' ' 33' ' ' LEU . 38.8 ttpt -99.13 126.13 44.82 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.069 0.548 . . . . 65.400000000000006 109.541 -178.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 35.0 m -92.0 117.21 29.6 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.276 0.63 . . . . 73.430000000000007 109.382 -177.092 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.6 mt -115.11 138.47 50.86 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.179 0.991 . . . . 52.450000000000003 109.407 -176.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 54.9 p -85.13 153.27 22.79 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 123.297 0.639 . . . . 71.310000000000002 110.568 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.402 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 71.7 p -119.52 172.73 4.14 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 124.291 1.037 . . . . 75.340000000000003 109.064 -174.444 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.402 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 86.4 Cg_endo -75.17 14.86 0.83 Allowed 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 122.185 1.923 . . . . 73.549999999999997 113.215 167.764 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.422 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 11.1 m120 -118.95 157.16 28.26 Favored 'General case' 0 C--N 1.353 0.723 0 C-N-CA 124.167 0.987 . . . . 51.140000000000001 109.361 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -100.76 -32.93 10.47 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 123.276 0.631 . . . . 62.130000000000003 109.931 175.096 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -71.6 -40.63 69.71 Favored 'General case' 0 C--O 1.215 -0.759 0 C-N-CA 123.0 0.52 . . . . 73.5 110.153 176.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.422 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -93.09 141.22 28.66 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.075 0.55 . . . . 62.350000000000001 111.487 -175.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.8 tp -140.49 133.2 28.9 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 108.455 -0.943 . . . . 65.299999999999997 108.455 172.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.4 tttt -93.25 131.52 38.29 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 123.824 0.85 . . . . 65.409999999999997 110.672 -173.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -120.17 121.02 37.84 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.826 1.25 . . . . 75.109999999999999 107.996 174.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.416 HD23 ' HE2' ' A' ' 20' ' ' LYS . 47.3 tp -106.77 128.8 54.54 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.567 0.747 . . . . 71.420000000000002 110.488 -171.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.2 m -73.91 106.09 5.46 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.319 -0.993 . . . . 64.219999999999999 108.319 171.134 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 15.4 m -105.85 -32.19 8.48 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.024 0.53 . . . . 63.240000000000002 111.797 -163.61 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.469 ' HB3' ' HB3' ' A' ' 18' ' ' HIS . 5.8 p-10 -82.55 -162.55 0.59 Allowed 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.273 0.229 . . . . 53.109999999999999 110.593 178.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -65.69 -16.67 63.8 Favored Glycine 0 C--N 1.355 1.589 0 N-CA-C 114.323 0.489 . . . . 51.240000000000002 114.323 -177.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 24.2 mm-40 -86.21 147.31 26.17 Favored 'General case' 0 C--N 1.352 0.688 0 CA-C-N 117.82 0.81 . . . . 54.229999999999997 110.266 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 25.4 ttt -147.05 130.64 16.84 Favored 'General case' 0 N--CA 1.473 0.713 0 N-CA-C 107.638 -1.245 . . . . 70.120000000000005 107.638 -173.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.424 ' O ' ' HA ' ' A' ' 114' ' ' ASP . 64.1 mt -54.15 -45.94 72.14 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 123.87 0.868 . . . . 23.23 112.176 -171.126 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.558 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 5.4 tt0 -145.37 152.68 40.25 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.117 1.367 . . . . 65.329999999999998 108.757 -179.566 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.2 m -73.96 150.08 40.97 Favored 'General case' 0 CA--C 1.558 1.272 0 C-N-CA 123.437 0.695 . . . . 72.430000000000007 109.772 171.755 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 29.4 mmm180 -57.5 97.02 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.825 0.85 . . . . 75.219999999999999 109.719 174.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -154.48 -47.94 0.01 OUTLIER Glycine 0 N--CA 1.466 0.698 0 CA-C-N 115.868 -0.606 . . . . 33.399999999999999 111.773 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 29.2 t -110.4 177.41 4.7 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.345 0.658 . . . . 70.040000000000006 110.839 179.507 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 62.0 mttm -97.36 -174.37 2.91 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.845 1.258 . . . . 74.340000000000003 110.925 -174.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . 0.4 ' HA ' ' O ' ' A' ' 79' ' ' ILE . 28.0 p -76.82 88.02 3.42 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.235 0.614 . . . . 73.140000000000001 110.1 175.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.618 HD12 HD13 ' A' ' 116' ' ' ILE . 54.7 mt -76.8 127.61 37.89 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 C-N-CA 123.803 0.841 . . . . 74.239999999999995 110.828 -177.189 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 95.6 t -89.79 123.81 42.17 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 N-CA-C 109.127 -0.694 . . . . 62.130000000000003 109.127 178.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.433 HG12 ' HB3' ' A' ' 57' ' ' LEU . 54.5 mt -116.02 110.11 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 N-CA-C 108.283 -1.006 . . . . 62.039999999999999 108.283 174.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 92.2 mttt -90.87 164.79 13.92 Favored 'General case' 0 C--O 1.245 0.82 0 N-CA-C 109.203 -0.666 . . . . 74.120000000000005 109.203 178.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 21.6 p30 -57.44 -27.35 62.36 Favored 'General case' 0 N--CA 1.479 1.002 0 O-C-N 124.168 0.918 . . . . 74.040000000000006 112.292 175.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 18.5 p -75.31 -33.76 61.2 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.64 0.776 . . . . 73.510000000000005 111.86 -179.365 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.414 ' O ' HG13 ' A' ' 58' ' ' ILE . 3.9 m-20 -78.86 74.23 5.39 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.431 0.692 . . . . 53.350000000000001 111.164 -170.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -50.49 -42.38 54.6 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.977 1.311 . . . . 73.040000000000006 111.565 -179.137 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -58.37 -49.25 77.91 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.752 0.821 . . . . 74.340000000000003 111.476 179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.433 ' HB3' HG12 ' A' ' 50' ' ' ILE . 80.4 mt -70.49 -38.82 74.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.538 0.735 . . . . 63.43 111.362 -175.596 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.414 HG13 ' O ' ' A' ' 54' ' ' ASP . 81.4 mt -57.76 -48.13 84.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.02 0.928 . . . . 75.439999999999998 109.443 175.078 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 89.5 m-20 -66.64 -26.05 66.88 Favored 'General case' 0 N--CA 1.478 0.929 0 N-CA-C 113.355 0.872 . . . . 62.310000000000002 113.355 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 41.3 m170 -70.52 -36.57 73.83 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 122.536 0.334 . . . . 73.239999999999995 111.383 178.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.41 ' HB3' HG23 ' A' ' 116' ' ' ILE . 38.5 p -116.62 105.72 12.75 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.518 0.727 . . . . 72.420000000000002 109.552 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -62.77 -19.94 64.48 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.993 0.517 . . . . 71.329999999999998 111.427 -179.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.575 HD11 HD12 ' A' ' 105' ' ' LEU . 48.7 tp -60.04 -46.98 87.72 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 123.366 0.666 . . . . 71.519999999999996 110.1 170.466 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.13 -41.81 99.38 Favored 'General case' 0 C--N 1.354 0.78 0 C-N-CA 123.242 0.617 . . . . 64.230000000000004 110.745 178.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -56.4 -48.6 76.59 Favored 'General case' 0 N--CA 1.479 0.977 0 O-C-N 123.861 0.726 . . . . 74.319999999999993 110.883 175.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 -60.51 -44.56 95.88 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.86 0.864 . . . . 63.32 112.79 178.749 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.517 HG22 HG21 ' A' ' 74' ' ' VAL . 97.1 mt -66.54 -46.41 86.39 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 C-N-CA 123.35 0.66 . . . . 75.099999999999994 110.605 -177.215 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.5 m-85 -68.95 -37.07 78.63 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 122.799 0.44 . . . . 75.340000000000003 111.779 178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 62.2 tp -66.82 -53.83 28.73 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.526 0.73 . . . . 73.299999999999997 110.604 -177.033 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 78.8 mt-30 -81.0 -24.05 38.25 Favored 'General case' 0 C--O 1.24 0.555 0 CA-C-N 114.941 -1.027 . . . . 70.140000000000001 111.666 -173.231 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 38.2 m -126.37 97.15 34.72 Favored Pre-proline 0 CA--C 1.552 1.031 0 N-CA-C 109.487 -0.56 . . . . 75.030000000000001 109.487 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_exo -68.11 -17.34 45.59 Favored 'Trans proline' 0 C--N 1.378 2.093 0 C-N-CA 123.59 2.86 . . . . 64.25 113.879 -178.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -89.96 13.59 64.21 Favored Glycine 0 C--N 1.346 1.11 0 CA-C-O 119.69 -0.505 . . . . 53.240000000000002 113.576 -177.246 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.517 HG21 HG22 ' A' ' 67' ' ' ILE . 41.6 t -85.69 122.4 38.39 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.621 0 N-CA-C 108.732 -0.84 . . . . 72.019999999999996 108.732 173.623 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.8 mt-10 -90.06 -40.49 12.26 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.509 0.724 . . . . 74.030000000000001 110.085 -177.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.9 p -160.1 170.85 20.38 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.486 -0.779 . . . . 51.030000000000001 110.832 -178.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 85.4 mt -131.61 150.52 52.12 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 125.045 1.338 . . . . 72.040000000000006 108.516 177.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.414 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 57.6 ttm -123.85 102.56 7.86 Favored 'General case' 0 C--O 1.24 0.568 0 N-CA-C 107.255 -1.387 . . . . 75.219999999999999 107.255 167.993 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.4 ' O ' ' HA ' ' A' ' 47' ' ' SER . 15.3 mm -82.5 120.45 33.96 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.376 0 CA-C-N 115.552 -0.749 . . . . 73.540000000000006 109.176 -177.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -109.06 -179.7 21.28 Favored Glycine 0 C--O 1.242 0.642 0 N-CA-C 111.41 -0.676 . . . . 64.340000000000003 111.41 172.558 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.558 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 4.5 p-10 -72.33 -53.8 11.32 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.294 0.638 . . . . 53.140000000000001 110.774 178.363 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 0.4 ' O ' HD12 ' A' ' 33' ' ' LEU . 14.0 p-10 -116.58 -0.3 12.47 Favored 'General case' 0 N--CA 1.485 1.293 0 O-C-N 121.755 -0.591 . . . . 72.420000000000002 111.435 177.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -126.52 156.24 41.09 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 109.754 -0.462 . . . . 72.310000000000002 109.754 -178.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.549 HD23 HD11 ' A' ' 105' ' ' LEU . 39.5 tp -144.84 119.69 9.92 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.216 -0.661 . . . . 72.099999999999994 109.216 176.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.414 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 32.9 m -107.59 108.35 19.59 Favored 'General case' 0 CA--C 1.539 0.556 0 N-CA-C 109.415 -0.587 . . . . 75.299999999999997 109.415 -177.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.511 ' HB ' ' HH2' ' A' ' 94' ' ' TRP . 21.1 mm -89.66 141.48 14.27 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.473 0 N-CA-C 108.259 -1.015 . . . . 74.340000000000003 108.259 -179.312 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.8 m-80 -114.31 119.67 37.76 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.601 -0.518 . . . . 75.010000000000005 109.601 179.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.676 ' HZ2' HD13 ' A' ' 97' ' ' ILE . 5.0 mptp? -105.45 159.31 16.03 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.684 1.194 . . . . 64.299999999999997 110.734 177.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.4 ' HB3' HG23 ' A' ' 92' ' ' VAL . 13.5 t70 -69.49 145.46 52.69 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 114.187 -1.369 . . . . 73.409999999999997 109.254 172.706 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.32 -25.69 68.42 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 123.886 0.874 . . . . 75.200000000000003 113.093 -176.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 65.6 mtm -87.58 -9.01 55.55 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.672 0.789 . . . . 74.540000000000006 111.276 179.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.4 HG23 ' HB3' ' A' ' 89' ' ' ASP . 39.8 t -102.53 135.98 37.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 109.528 -0.545 . . . . 71.439999999999998 109.528 -179.876 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 20.0 m170 -79.64 138.17 37.32 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.233 1.013 . . . . 61.009999999999998 111.387 -172.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.511 ' HH2' ' HB ' ' A' ' 86' ' ' ILE . 6.0 m95 -80.38 -52.8 7.25 Favored 'General case' 0 N--CA 1.483 1.217 0 N-CA-C 113.277 0.844 . . . . 73.219999999999999 113.277 -174.794 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -60.87 -18.16 54.52 Favored 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 123.782 0.833 . . . . 63.409999999999997 112.843 -174.664 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 10.1 t -74.67 -40.77 61.21 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 124.168 0.987 . . . . 64.519999999999996 110.267 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.676 HD13 ' HZ2' ' A' ' 88' ' ' LYS . 16.2 mt -94.12 -15.54 7.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 CA-C-N 115.162 -0.926 . . . . 73.409999999999997 112.552 -168.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 28.8 mtmm -49.63 -47.89 77.64 Favored Pre-proline 0 N--CA 1.491 1.579 0 CA-C-O 118.193 -0.908 . . . . 71.329999999999998 113.114 -179.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -56.36 -39.12 93.39 Favored 'Trans proline' 0 C--N 1.396 3.073 0 C-N-CA 122.012 1.808 . . . . 60.030000000000001 113.126 176.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.461 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 8.3 mm-40 -63.61 -50.95 67.36 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.344 0.658 . . . . 74.109999999999999 110.403 -178.674 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.44 ' O ' HD13 ' A' ' 105' ' ' LEU . 76.4 mt -61.17 -54.84 29.72 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.66 0 CA-C-N 115.017 -0.992 . . . . 74.239999999999995 110.489 -177.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 89.1 mt -55.37 -38.28 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 123.511 0.724 . . . . 74.230000000000004 110.96 -178.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -66.17 -43.69 86.19 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.493 0.717 . . . . 73.540000000000006 111.112 179.05 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.461 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 88.9 mt -64.35 -38.57 91.52 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.463 0.705 . . . . 74.230000000000004 111.194 178.23 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.575 HD12 HD11 ' A' ' 63' ' ' LEU . 10.0 mp -63.52 -34.45 77.81 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.645 0.778 . . . . 75.230000000000004 110.277 174.043 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.421 HG23 ' HB ' ' A' ' 17' ' ' ILE . 93.1 m -72.96 -31.32 64.48 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.302 0.641 . . . . 74.0 110.102 178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 27.9 mtpp -63.86 -54.42 35.22 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.9 0.48 . . . . 61.219999999999999 110.35 176.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -58.27 -45.05 88.58 Favored 'General case' 0 N--CA 1.483 1.206 0 O-C-N 123.824 0.703 . . . . 73.439999999999998 111.541 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.402 HD21 ' HA ' ' A' ' 40' ' ' LEU . 95.8 mt -75.93 -17.83 59.6 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 115.091 -0.959 . . . . 50.229999999999997 111.434 -177.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.34 -28.8 59.75 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.143 0.577 . . . . 63.219999999999999 110.418 172.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 26.3 m-85 -72.31 -27.09 62.23 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-N 116.148 -0.478 . . . . 65.120000000000005 109.921 168.71 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 72.67 30.38 64.12 Favored Glycine 0 C--N 1.353 1.516 0 CA-C-N 115.513 -0.767 . . . . 65.329999999999998 111.213 -172.623 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -92.91 139.96 29.98 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 124.441 1.096 . . . . 74.340000000000003 111.151 -171.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.424 ' HA ' ' O ' ' A' ' 40' ' ' LEU . 5.8 m-20 -76.65 119.11 20.01 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 108.474 -0.936 . . . . 74.519999999999996 108.474 169.331 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 2.7 p -49.15 -50.03 15.74 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.074 0 C-N-CA 125.636 1.574 . . . . 53.530000000000001 112.385 -176.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.618 HD13 HD12 ' A' ' 48' ' ' ILE . 1.7 pp -160.03 162.67 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 C-N-CA 125.854 1.662 . . . . 72.239999999999995 107.588 173.098 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 55.6 m -104.43 -87.69 0.44 Allowed 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 107.019 -1.474 . . . . 64.109999999999999 107.019 165.042 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -122.73 -34.74 3.17 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 123.085 0.554 . . . . 72.349999999999994 111.246 -174.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 . . . . . 0 C--O 1.254 1.325 0 N-CA-C 109.191 -0.67 . . . . 70.540000000000006 109.191 -178.248 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.486 1.368 0 N-CA-C 109.737 -0.468 . . . . 62.43 109.737 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -115.04 23.82 11.22 Favored Glycine 0 C--N 1.351 1.377 0 CA-C-N 115.981 -0.554 . . . . 51.32 112.368 178.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.2 m-70 -75.8 87.31 2.81 Favored 'General case' 0 C--N 1.353 0.718 0 N-CA-C 108.246 -1.02 . . . . 65.409999999999997 108.246 174.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 70.5 t60 -73.0 107.03 5.13 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 108.904 -0.776 . . . . 72.430000000000007 108.904 178.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -76.62 124.87 28.28 Favored 'General case' 0 CA--C 1.54 0.592 0 O-C-N 124.155 0.91 . . . . 73.450000000000003 110.664 -175.004 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 25.7 p-80 -142.25 70.08 1.33 Allowed 'General case' 0 CA--C 1.543 0.701 0 CA-C-O 122.112 0.958 . . . . 74.409999999999997 109.384 177.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 66.1 t60 -112.36 102.84 10.96 Favored 'General case' 0 N--CA 1.476 0.847 0 CA-C-N 114.916 -1.038 . . . . 75.420000000000002 109.777 -177.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 25.1 p-80 -158.79 44.14 0.27 Allowed 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.713 0.805 . . . . 74.040000000000006 109.997 177.846 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.4 m -117.04 98.39 6.44 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 109.533 -0.543 . . . . 74.219999999999999 109.533 174.6 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 13.5 p80 -167.09 139.87 3.5 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.244 1.017 . . . . 74.349999999999994 109.281 177.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 55.7 tpp -134.41 95.26 3.35 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 108.467 -0.938 . . . . 70.049999999999997 108.467 174.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -73.99 -20.93 60.18 Favored 'General case' 0 N--CA 1.483 1.205 0 CA-C-N 115.387 -0.824 . . . . 62.509999999999998 111.123 -178.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 19.7 m -79.32 33.9 0.24 Allowed 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 124.377 1.071 . . . . 73.329999999999998 112.554 -177.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 15.7 mm100 -93.91 27.77 2.65 Favored 'General case' 0 N--CA 1.483 1.189 0 O-C-N 121.679 -0.638 . . . . 74.140000000000001 111.724 177.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -82.48 173.96 11.52 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.814 0.846 . . . . 53.210000000000001 109.955 172.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -132.0 128.27 38.02 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 108.133 -1.062 . . . . 71.319999999999993 108.133 172.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 63.8 mt -78.22 117.51 23.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.111 0.564 . . . . 73.109999999999999 109.808 -176.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 15.8 t60 -72.31 122.24 20.81 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 115.421 -0.809 . . . . 73.329999999999998 109.564 -179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.8 mm -115.55 122.22 68.91 Favored 'Isoleucine or valine' 0 C--O 1.243 0.726 0 N-CA-C 105.599 -2.0 . . . . 51.539999999999999 105.599 177.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 36.9 ttpt -91.01 120.59 32.13 Favored 'General case' 0 N--CA 1.467 0.387 0 N-CA-C 108.308 -0.997 . . . . 74.25 108.308 -172.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 81.7 m -93.25 113.29 25.46 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.522 -0.918 . . . . 63.520000000000003 108.522 -176.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 92.9 mt -105.83 138.14 42.53 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 123.601 0.76 . . . . 44.530000000000001 109.388 179.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 30.0 p -73.71 142.63 46.34 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.708 0.803 . . . . 71.420000000000002 110.695 178.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 9.3 p -113.09 168.0 8.4 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 124.681 1.192 . . . . 71.030000000000001 109.827 -174.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -67.73 -10.87 30.21 Favored 'Trans proline' 0 C--N 1.383 2.388 0 C-N-CA 122.693 2.262 . . . . 71.420000000000002 113.459 174.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 38.4 m-80 -125.12 134.52 52.42 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.456 0.702 . . . . 71.439999999999998 109.761 -178.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -73.2 -24.85 60.57 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 123.279 0.632 . . . . 53.119999999999997 110.973 173.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -66.08 -20.75 66.26 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.115 0.966 . . . . 60.210000000000001 111.218 176.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -123.1 162.56 22.22 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.24 1.016 . . . . 74.409999999999997 110.107 -179.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 26.4 tp -160.66 131.24 5.36 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 109.571 -0.529 . . . . 71.140000000000001 109.571 173.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -85.44 117.11 24.16 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.281 1.032 . . . . 72.530000000000001 110.85 -174.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 78.2 m-85 -107.77 110.8 22.7 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.399 1.079 . . . . 73.439999999999998 108.216 173.29 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.6 tp -102.84 123.61 46.81 Favored 'General case' 0 C--O 1.243 0.744 0 N-CA-C 108.674 -0.861 . . . . 55.130000000000003 108.674 -169.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 67.1 p -80.87 106.21 12.7 Favored 'General case' 0 C--O 1.242 0.692 0 N-CA-C 107.828 -1.175 . . . . 71.439999999999998 107.828 178.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 40.2 p -109.89 -58.52 2.05 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 123.765 0.826 . . . . 74.430000000000007 110.181 -175.275 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -69.72 110.29 4.82 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.135 0.974 . . . . 63.130000000000003 111.607 -172.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 77.08 -85.23 1.01 Allowed Glycine 0 C--N 1.342 0.911 0 O-C-N 124.107 0.879 . . . . 63.100000000000001 112.989 174.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 20.8 mp0 -95.62 164.14 12.9 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.9 0.88 . . . . 62.439999999999998 111.993 -170.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 28.3 ttt -125.58 147.28 49.34 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 126.077 1.751 . . . . 63.200000000000003 107.554 -177.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 98.7 mt -67.35 -51.97 45.84 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 113.085 0.772 . . . . 61.329999999999998 113.085 -169.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.62 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.1 tt0 -141.78 163.43 32.92 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.239 0.616 . . . . 70.099999999999994 109.55 -172.148 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.6 m -70.08 134.87 48.66 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.617 0.767 . . . . 74.409999999999997 110.256 174.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 43.2 ttm180 -71.24 155.36 40.8 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.989 0.516 . . . . 74.340000000000003 110.151 174.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 89.92 47.03 4.03 Favored Glycine 0 C--N 1.345 1.054 0 N-CA-C 109.829 -1.308 . . . . 75.310000000000002 109.829 -172.199 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 77.5 p -148.54 173.16 13.43 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.105 0.962 . . . . 73.409999999999997 110.04 -172.125 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -98.26 162.49 13.16 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.635 0.774 . . . . 75.140000000000001 110.067 178.185 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.8 p -82.82 99.5 9.74 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 123.615 0.766 . . . . 70.340000000000003 109.774 176.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 54.0 mt -76.87 107.73 8.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 123.142 0.577 . . . . 73.400000000000006 110.377 -173.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 76.8 t -87.55 105.34 15.17 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 108.046 -1.094 . . . . 74.239999999999995 108.046 179.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 75.2 mt -94.83 109.09 21.73 Favored 'Isoleucine or valine' 0 C--N 1.337 0.062 0 N-CA-C 107.999 -1.112 . . . . 75.129999999999995 107.999 -178.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 48.3 mtmt -87.64 142.22 28.01 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.679 0.792 . . . . 72.420000000000002 109.77 -176.308 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.505 ' HA ' HD11 ' A' ' 58' ' ' ILE . 36.9 p30 -67.43 -22.45 65.51 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.245 0.618 . . . . 74.349999999999994 111.574 -179.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 14.2 t -87.85 -4.79 58.83 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.95 0.9 . . . . 71.420000000000002 112.043 178.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -108.11 103.7 12.97 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.102 0.561 . . . . 62.340000000000003 110.186 -175.24 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -45.44 -61.97 1.46 Allowed 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 124.932 1.293 . . . . 55.299999999999997 113.605 176.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -69.65 -30.95 68.76 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 112.758 0.651 . . . . 53.310000000000002 112.758 -166.062 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 57.8 mt -64.17 -36.17 83.18 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 123.397 0.436 . . . . 73.319999999999993 111.666 175.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.505 HD11 ' HA ' ' A' ' 52' ' ' ASN . 39.6 mt -84.22 -38.17 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.319 0 C-N-CA 123.309 0.644 . . . . 62.130000000000003 110.381 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -56.19 -39.85 73.06 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 125.061 1.344 . . . . 64.400000000000006 112.15 -178.235 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -85.98 -1.98 57.85 Favored 'General case' 0 CA--C 1.553 1.077 0 CA-C-N 115.798 -0.637 . . . . 71.409999999999997 111.566 -176.685 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.525 ' HB3' HG12 ' A' ' 116' ' ' ILE . 34.0 p -127.78 101.38 6.33 Favored 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 123.208 0.603 . . . . 73.219999999999999 111.135 -172.828 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 16.1 tppt? -57.65 -47.28 82.72 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.473 1.109 . . . . 74.319999999999993 112.287 -177.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.403 HD11 HD12 ' A' ' 105' ' ' LEU . 49.5 tp -63.93 -35.99 82.47 Favored 'General case' 0 N--CA 1.479 0.986 0 O-C-N 123.912 0.758 . . . . 74.310000000000002 111.409 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.39 -40.94 89.96 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 122.668 0.387 . . . . 72.109999999999999 111.189 178.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.419 ' HG2' HG22 ' A' ' 58' ' ' ILE . 96.6 mt-30 -58.79 -43.5 90.5 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 124.241 0.963 . . . . 72.549999999999997 110.242 176.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -58.66 -51.45 69.88 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.644 0.778 . . . . 75.140000000000001 112.519 174.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 83.3 mt -66.18 -44.54 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.073 0 C-N-CA 123.434 0.694 . . . . 62.509999999999998 111.35 -173.563 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 33.3 m-85 -71.13 -37.69 72.3 Favored 'General case' 0 N--CA 1.485 1.289 0 N-CA-C 112.243 0.46 . . . . 72.0 112.243 179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 42.9 tp -69.87 -45.92 66.65 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 122.865 0.466 . . . . 71.340000000000003 110.919 -177.466 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -81.08 -29.88 34.84 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.222 0.609 . . . . 74.530000000000001 111.691 -178.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 63.9 m -133.28 88.11 36.5 Favored Pre-proline 0 CA--C 1.548 0.904 0 N-CA-C 109.057 -0.72 . . . . 73.420000000000002 109.057 -178.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -77.02 -2.32 12.56 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 122.735 2.29 . . . . 72.099999999999994 112.758 -179.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.04 3.4 71.13 Favored Glycine 0 C--N 1.356 1.659 0 CA-C-N 116.327 -0.397 . . . . 71.430000000000007 113.18 176.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.0 t -92.68 133.3 34.42 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.405 1.082 . . . . 74.409999999999997 109.974 175.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.458 ' H ' ' HA ' ' A' ' 88' ' ' LYS . 16.2 mm-40 -86.16 -49.95 7.36 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 124.381 1.072 . . . . 72.340000000000003 110.703 -179.532 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.6 p -159.21 163.46 35.91 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.488 -0.778 . . . . 71.409999999999997 111.066 -175.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 66.4 mt -121.86 125.98 47.68 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 108.535 -0.913 . . . . 54.25 108.535 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.6 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.1 ttm -98.64 99.82 10.98 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 106.897 -1.519 . . . . 61.399999999999999 106.897 174.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.636 HD13 HD13 ' A' ' 84' ' ' LEU . 19.1 mm -85.41 110.67 19.78 Favored 'Isoleucine or valine' 0 C--O 1.242 0.662 0 N-CA-C 108.765 -0.828 . . . . 75.420000000000002 108.765 -172.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -101.25 173.68 24.38 Favored Glycine 0 C--O 1.247 0.931 0 N-CA-C 109.802 -1.319 . . . . 63.119999999999997 109.802 173.285 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.62 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 10.5 p-10 -74.93 -44.66 47.32 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 122.87 0.468 . . . . 64.329999999999998 110.022 175.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 39.2 m-20 -86.81 -41.72 13.85 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.448 0.699 . . . . 70.230000000000004 111.468 179.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 36.4 p90 -131.2 171.62 13.08 Favored 'General case' 0 N--CA 1.482 1.149 0 CA-C-O 121.247 0.546 . . . . 72.400000000000006 112.204 -164.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.636 HD13 HD13 ' A' ' 79' ' ' ILE . 14.1 tp -139.51 110.8 6.99 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 124.731 1.212 . . . . 63.530000000000001 107.915 179.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.6 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 66.7 m -95.42 108.18 20.37 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.088 -1.079 . . . . 70.549999999999997 108.088 -177.787 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.613 HG13 HD13 ' A' ' 101' ' ' ILE . 12.0 mm -87.01 102.9 12.71 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 C-N-CA 123.501 0.72 . . . . 74.340000000000003 109.152 -173.456 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 70.7 m-20 -84.2 128.08 34.34 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 107.33 -1.359 . . . . 72.329999999999998 107.33 175.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.458 ' HA ' ' H ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -148.93 168.1 23.98 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 123.603 0.761 . . . . 73.209999999999994 111.867 -171.28 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -71.42 122.79 21.01 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.197 1.399 . . . . 71.310000000000002 109.799 179.092 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 12.7 ptm180 -71.45 -12.5 61.43 Favored 'General case' 0 N--CA 1.483 1.212 0 N-CA-C 113.147 0.795 . . . . 72.120000000000005 113.147 -170.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.7 mmm -78.06 -30.94 50.02 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.754 -0.461 . . . . 75.299999999999997 109.754 175.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 17.6 t -83.34 144.94 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 107.923 -1.14 . . . . 75.329999999999998 107.923 175.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 39.6 m-70 -102.14 158.65 16.01 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.3 0.64 . . . . 72.400000000000006 111.636 -171.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -75.68 -24.73 56.31 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.977 0.911 . . . . 72.219999999999999 112.143 178.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -59.86 -27.32 66.58 Favored 'General case' 0 CA--C 1.551 1.015 0 C-N-CA 123.423 0.689 . . . . 64.439999999999998 111.223 178.299 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.2 m -92.79 -35.55 13.35 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 123.954 0.902 . . . . 62.240000000000002 112.412 178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.433 HG22 HD11 ' A' ' 101' ' ' ILE . 24.5 mt -93.28 -45.66 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 CA-C-N 117.861 0.301 . . . . 52.140000000000001 111.212 -170.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 26.9 ttpp -53.5 -46.29 98.19 Favored Pre-proline 0 N--CA 1.492 1.674 0 N-CA-C 114.522 1.304 . . . . 72.400000000000006 114.522 -174.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 15.2 Cg_endo -55.41 -39.59 90.2 Favored 'Trans proline' 0 C--N 1.392 2.866 0 C-N-CA 121.803 1.668 . . . . 62.119999999999997 112.168 175.37 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -68.22 -40.45 82.08 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.466 -0.788 . . . . 75.530000000000001 110.382 -179.636 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.613 HD13 HG13 ' A' ' 86' ' ' ILE . 84.8 mt -62.48 -52.01 65.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 123.551 0.74 . . . . 72.120000000000005 110.364 179.981 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 79.4 mt -61.32 -37.54 77.86 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.09 0 C-N-CA 123.369 0.668 . . . . 63.299999999999997 110.83 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -66.25 -47.69 72.92 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.431 0.692 . . . . 53.32 111.057 178.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 98.4 mt -68.44 -35.26 77.35 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.761 0.825 . . . . 62.530000000000001 111.99 -179.012 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.403 HD12 HD11 ' A' ' 63' ' ' LEU . 9.0 mp -69.34 -23.79 63.82 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.315 0.646 . . . . 71.299999999999997 110.492 175.084 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 53.8 m -78.9 -44.96 21.58 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 123.265 0.626 . . . . 72.230000000000004 109.993 173.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 47.2 mmtm -57.46 -49.58 75.82 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.017 0.927 . . . . 64.310000000000002 110.483 -179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 3.4 tt0 -50.57 -60.74 2.71 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.556 1.142 . . . . 74.519999999999996 111.366 175.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 89.4 mt -75.43 -19.11 59.68 Favored 'General case' 0 CA--C 1.552 1.05 0 CA-C-N 115.682 -0.69 . . . . 74.540000000000006 112.058 -170.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -81.53 -46.72 14.07 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 123.599 0.76 . . . . 74.450000000000003 110.769 -179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -80.15 -15.02 57.99 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 115.92 -0.582 . . . . 64.340000000000003 111.208 177.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 84.45 19.27 60.63 Favored Glycine 0 C--N 1.35 1.316 0 CA-C-N 116.405 -0.361 . . . . 74.0 112.796 178.178 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -70.15 167.75 17.12 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 124.442 1.097 . . . . 71.349999999999994 111.148 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -98.36 139.4 34.18 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.323 1.049 . . . . 64.450000000000003 110.172 -174.548 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 4.1 p -66.88 -49.59 72.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 N-CA-C 108.868 -0.79 . . . . 70.109999999999999 108.868 165.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.569 HD11 HG13 ' A' ' 79' ' ' ILE . 71.0 mt -140.49 -59.67 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.532 0 N-CA-C 106.224 -1.769 . . . . 52.539999999999999 106.224 177.38 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 60.2 p -157.23 134.91 10.72 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 113.747 -1.569 . . . . 54.32 108.189 171.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -87.67 41.2 0.97 Allowed 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 124.013 0.925 . . . . 64.420000000000002 109.875 176.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 . . . . . 0 C--O 1.253 1.268 0 N-CA-C 107.115 -1.439 . . . . 73.109999999999999 107.115 -172.637 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 84.2 mtp . . . . . 0 N--CA 1.482 1.17 0 N-CA-C 109.225 -0.657 . . . . 52.25 109.225 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 71.54 -145.76 39.35 Favored Glycine 0 C--N 1.35 1.317 0 O-C-N 123.68 0.613 . . . . 73.209999999999994 111.784 -176.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.3 m-70 64.77 5.66 2.92 Favored 'General case' 0 N--CA 1.492 1.655 0 C-N-CA 124.577 1.151 . . . . 73.120000000000005 112.673 174.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 39.1 t-80 -77.97 112.78 15.22 Favored 'General case' 0 C--N 1.353 0.718 0 C-N-CA 122.881 0.472 . . . . 74.349999999999994 110.449 -173.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -127.53 -73.37 0.61 Allowed 'General case' 0 C--O 1.24 0.605 0 CA-C-N 115.516 -0.766 . . . . 74.540000000000006 109.159 174.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 93.3 m-70 49.23 44.8 23.44 Favored 'General case' 0 N--CA 1.485 1.291 0 CA-C-O 121.625 0.726 . . . . 65.129999999999995 110.151 -168.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 37.2 t60 -64.31 95.64 0.14 Allowed 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 114.139 -1.391 . . . . 62.329999999999998 110.607 -170.557 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 85.0 m-70 -138.86 122.1 16.99 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.336 -0.847 . . . . 63.32 109.497 -179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.4 t -120.51 84.69 2.26 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.354 1.062 . . . . 74.200000000000003 108.248 178.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.9 t60 -158.67 129.29 6.1 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.858 0.863 . . . . 72.340000000000003 109.778 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -159.14 129.86 5.98 Favored 'General case' 0 C--O 1.24 0.57 0 C-N-CA 123.147 0.579 . . . . 75.530000000000001 110.111 172.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 12.2 t30 -124.38 87.7 2.77 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 107.985 -1.117 . . . . 62.130000000000003 107.985 171.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 41.6 m -137.05 76.37 1.58 Allowed 'General case' 0 C--O 1.24 0.602 0 CA-C-N 115.037 -0.983 . . . . 73.519999999999996 108.895 -177.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 43.2 mt-30 -110.13 -53.48 2.67 Favored 'General case' 0 N--CA 1.477 0.902 0 CA-C-N 114.924 -1.035 . . . . 64.239999999999995 110.042 -174.266 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -133.91 124.98 27.33 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.68 0.792 . . . . 72.549999999999997 110.245 -174.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -148.35 119.19 7.58 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 108.238 -1.023 . . . . 74.140000000000001 108.238 169.856 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 50.0 mt -115.46 107.89 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 N-CA-C 109.136 -0.69 . . . . 75.319999999999993 109.136 -179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 54.9 m80 -64.15 118.54 8.72 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.848 1.259 . . . . 74.129999999999995 110.389 178.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 42.1 mm -122.37 113.42 38.45 Favored 'Isoleucine or valine' 0 C--O 1.234 0.25 0 N-CA-C 106.193 -1.78 . . . . 75.219999999999999 106.193 -179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -105.57 119.96 40.44 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 106.891 -1.522 . . . . 65.430000000000007 106.891 -175.449 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.503 HG21 ' HD2' ' A' ' 98' ' ' LYS . 12.3 t -109.58 111.81 23.53 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-O 121.834 0.826 . . . . 72.120000000000005 108.934 -171.458 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 72.0 mt -91.56 147.6 22.89 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.152 -0.931 . . . . 73.299999999999997 111.342 -174.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.9 p -81.66 145.86 30.34 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 114.669 -1.15 . . . . 74.25 110.011 176.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 50.1 p -115.81 176.65 1.44 Allowed Pre-proline 0 CA--C 1.55 0.978 0 N-CA-C 107.939 -1.134 . . . . 73.319999999999993 107.939 -179.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_exo -49.8 -30.35 22.89 Favored 'Trans proline' 0 C--N 1.384 2.41 0 C-N-CA 122.079 1.852 . . . . 45.32 113.4 165.548 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 42.2 t-20 -86.19 146.26 26.63 Favored 'General case' 0 CA--C 1.547 0.829 0 N-CA-C 109.083 -0.71 . . . . 73.030000000000001 109.083 174.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -88.76 -36.22 16.24 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.946 0.898 . . . . 71.230000000000004 110.838 177.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -91.49 -17.39 25.78 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.461 1.104 . . . . 53.420000000000002 111.982 -171.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -99.77 109.34 21.77 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 108.219 -1.03 . . . . 75.450000000000003 108.219 169.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 25.2 tp -114.96 126.77 55.16 Favored 'General case' 0 N--CA 1.477 0.884 0 N-CA-C 108.696 -0.853 . . . . 52.399999999999999 108.696 -175.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 65.5 tttm -92.47 110.08 21.48 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.088 0.955 . . . . 75.340000000000003 110.294 -170.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -92.56 127.19 37.96 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.599 0.76 . . . . 74.230000000000004 109.642 -177.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.3 tp -117.65 137.94 52.31 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.565 0.746 . . . . 73.200000000000003 109.835 -179.156 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.0 t -89.99 121.27 31.93 Favored 'General case' 0 N--CA 1.47 0.546 0 N-CA-C 108.314 -0.995 . . . . 65.120000000000005 108.314 170.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 34.3 p -99.6 0.62 42.53 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.455 0.539 . . . . 72.239999999999995 112.455 -176.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -103.53 33.11 3.49 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.022 0.529 . . . . 73.349999999999994 111.721 -179.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 87.68 -44.99 3.29 Favored Glycine 0 C--N 1.347 1.151 0 CA-C-O 119.755 -0.47 . . . . 73.439999999999998 113.97 171.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.518 ' HB3' HD22 ' A' ' 109' ' ' LEU . 9.3 mm-40 -59.29 92.06 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.68 0.792 . . . . 64.340000000000003 112.764 -177.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 51.4 ttm -78.94 138.54 38.13 Favored 'General case' 0 CA--C 1.545 0.766 0 CA-C-N 114.822 -1.081 . . . . 53.43 109.104 173.552 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.3 mt -63.86 -56.14 17.59 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.772 0.829 . . . . 62.450000000000003 111.279 -172.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -129.68 133.84 47.32 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 107.895 -1.15 . . . . 65.25 107.895 173.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.9 p -57.68 137.46 56.43 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 123.544 0.738 . . . . 75.549999999999997 111.605 -173.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 63.9 ttt180 -59.44 120.63 9.7 Favored 'General case' 0 CA--C 1.549 0.933 0 O-C-N 124.031 0.832 . . . . 75.200000000000003 111.544 -168.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 135.75 -6.86 4.17 Favored Glycine 0 CA--C 1.526 0.73 0 CA-C-N 114.864 -1.062 . . . . 73.25 111.017 -168.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 47.0 t -76.3 174.92 9.58 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.917 1.287 . . . . 60.009999999999998 111.27 178.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.401 ' N ' ' HD2' ' A' ' 46' ' ' LYS . 0.0 OUTLIER -112.79 158.13 20.49 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.585 1.154 . . . . 74.200000000000003 108.383 177.186 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.5 m -76.58 93.29 3.56 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.314 0.645 . . . . 74.450000000000003 110.038 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.442 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 56.1 mt -74.87 104.54 3.33 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 C-N-CA 123.596 0.758 . . . . 72.230000000000004 110.246 -177.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.4 t -81.29 108.69 14.79 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 123.443 0.697 . . . . 73.200000000000003 109.165 -178.106 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.533 HD11 HD11 ' A' ' 116' ' ' ILE . 53.3 mt -106.06 108.36 24.88 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.743 0 N-CA-C 107.348 -1.353 . . . . 73.109999999999999 107.348 175.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 50.1 mttp -94.71 166.01 12.21 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 108.725 -0.842 . . . . 73.519999999999996 108.725 175.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.46 ' HA ' HD11 ' A' ' 58' ' ' ILE . 30.7 p30 -70.9 -8.9 56.19 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 120.65 0.262 . . . . 62.350000000000001 111.548 174.723 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.3 p -85.56 -25.31 26.82 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.494 0.718 . . . . 70.109999999999999 110.928 171.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -86.39 70.68 10.51 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 123.254 0.622 . . . . 74.409999999999997 109.495 177.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -56.65 -37.45 70.79 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.529 -0.759 . . . . 71.120000000000005 111.025 177.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -53.08 -44.83 67.86 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 124.614 1.166 . . . . 75.420000000000002 111.734 176.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.6 mt -73.39 -30.39 63.24 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-N 116.084 -0.507 . . . . 63.329999999999998 111.659 -179.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.46 HD11 ' HA ' ' A' ' 52' ' ' ASN . 77.6 mt -70.17 -43.47 78.79 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.938 0 C-N-CA 123.648 0.779 . . . . 65.200000000000003 110.66 179.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 46.4 m-80 -54.08 -39.52 66.4 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 123.647 0.779 . . . . 61.119999999999997 112.703 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 2.7 p-80 -99.08 28.84 4.17 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-O 120.88 0.371 . . . . 74.439999999999998 111.907 -177.542 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 33.6 t -151.25 100.31 2.74 Favored 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 108.652 -0.869 . . . . 75.340000000000003 108.652 173.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.7 ttmm -56.95 -38.34 72.82 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.769 0.828 . . . . 73.450000000000003 110.288 177.416 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.539 HD11 HD12 ' A' ' 105' ' ' LEU . 31.8 tp -59.91 -45.08 93.72 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 124.124 0.89 . . . . 65.450000000000003 110.492 178.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.61 -43.41 96.94 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.1 0.56 . . . . 64.150000000000006 111.645 177.72 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -56.29 -50.65 70.82 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 124.14 0.9 . . . . 70.219999999999999 110.758 178.855 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 18.1 mm100 -66.4 -39.03 88.77 Favored 'General case' 0 CA--C 1.544 0.727 0 O-C-N 124.299 1.0 . . . . 73.109999999999999 112.365 -177.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.439 HG21 HD21 ' A' ' 77' ' ' LEU . 77.8 mt -64.94 -50.61 74.19 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 122.561 0.344 . . . . 53.229999999999997 110.883 179.111 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -67.51 -31.43 71.54 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.696 0.398 . . . . 72.219999999999999 111.736 179.54 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.8 tp -69.98 -53.59 17.05 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.04 0.536 . . . . 74.349999999999994 110.734 179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.8 mt-30 -71.95 -29.32 64.14 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 115.672 -0.694 . . . . 64.230000000000004 111.205 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.645 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 37.9 m -132.29 93.23 26.34 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 123.119 0.568 . . . . 53.439999999999998 110.009 -176.786 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -74.29 -10.43 22.41 Favored 'Trans proline' 0 C--N 1.37 1.689 0 C-N-CA 122.981 2.454 . . . . 62.420000000000002 113.357 178.303 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -82.18 -3.05 90.69 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-O 119.988 -0.34 . . . . 64.209999999999994 113.407 179.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 91.7 t -77.18 121.73 30.25 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.708 0 C-N-CA 123.542 0.737 . . . . 75.010000000000005 109.66 175.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -74.47 -48.78 25.3 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.854 0.862 . . . . 74.430000000000007 109.706 179.431 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.8 t -162.5 154.81 19.02 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 114.401 -1.272 . . . . 45.43 110.717 -170.294 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.439 HD21 HG21 ' A' ' 67' ' ' ILE . 36.2 mt -108.35 158.11 17.79 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 125.096 1.359 . . . . 73.099999999999994 108.745 169.614 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.439 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.0 ttm -137.49 113.92 10.21 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.246 -1.02 . . . . 75.349999999999994 108.246 170.439 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.602 HD13 HD13 ' A' ' 84' ' ' LEU . 22.0 mm -88.91 118.55 34.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.201 0 N-CA-C 107.958 -1.127 . . . . 63.240000000000002 107.958 -175.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -108.51 -164.21 20.86 Favored Glycine 0 C--O 1.242 0.652 0 N-CA-C 111.852 -0.499 . . . . 75.450000000000003 111.852 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -73.13 -74.68 0.16 Allowed 'General case' 0 C--O 1.238 0.458 0 N-CA-C 108.302 -0.999 . . . . 70.450000000000003 108.302 174.125 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -87.48 -19.79 27.46 Favored 'General case' 0 C--O 1.239 0.54 0 C-N-CA 125.088 1.355 . . . . 74.140000000000001 111.122 -176.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.2 p90 -119.77 160.49 22.49 Favored 'General case' 0 N--CA 1.464 0.228 0 N-CA-C 112.808 0.67 . . . . 74.239999999999995 112.808 -164.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.602 HD13 HD13 ' A' ' 79' ' ' ILE . 28.3 tp -135.99 109.77 8.11 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 114.415 -1.266 . . . . 73.010000000000005 107.803 170.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.439 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 36.9 m -96.21 108.44 20.91 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 109.317 -0.623 . . . . 74.239999999999995 109.317 -176.539 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 26.3 mm -90.67 127.56 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.462 0 N-CA-C 108.984 -0.747 . . . . 55.420000000000002 108.984 179.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 22.1 m-80 -107.8 128.52 54.67 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 108.011 -1.107 . . . . 55.549999999999997 108.011 178.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.6 170.25 16.25 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.75 0.82 . . . . 74.530000000000001 110.106 178.35 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -85.26 134.78 34.12 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 109.515 -0.55 . . . . 74.319999999999993 109.515 173.328 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.2 ptp180 -55.1 -31.31 61.12 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 124.31 1.044 . . . . 70.129999999999995 113.656 -174.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 84.0 mtp -67.49 -26.79 66.53 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 122.721 0.408 . . . . 74.109999999999999 111.146 -177.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 18.6 t -89.41 136.5 23.43 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 107.902 -1.147 . . . . 73.0 107.902 173.651 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -91.85 150.51 21.02 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.899 0.48 . . . . 73.219999999999999 111.537 -173.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -68.09 -15.71 63.71 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.243 0.617 . . . . 71.209999999999994 110.49 169.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -57.7 -31.01 65.97 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 124.115 0.966 . . . . 73.409999999999997 111.555 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 21.9 t -103.19 -17.12 15.49 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 123.406 0.682 . . . . 71.219999999999999 111.405 178.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.645 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 68.3 mt -100.96 -58.64 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.104 0 C-N-CA 122.961 0.504 . . . . 70.540000000000006 111.13 -171.266 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.503 ' HD2' HG21 ' A' ' 21' ' ' THR . 27.7 ttpp -59.92 -46.24 98.2 Favored Pre-proline 0 CA--C 1.567 1.602 0 N-CA-C 114.606 1.336 . . . . 70.120000000000005 114.606 -170.462 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 26.8 Cg_endo -60.29 -35.16 92.61 Favored 'Trans proline' 0 C--N 1.396 3.057 0 CA-C-N 122.002 1.751 . . . . 72.349999999999994 112.02 178.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -66.74 -46.45 75.39 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 115.463 -0.79 . . . . 63.420000000000002 109.837 179.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.41 ' O ' HD13 ' A' ' 105' ' ' LEU . 50.1 mt -67.42 -45.86 84.73 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 O-C-N 123.979 0.799 . . . . 74.329999999999998 111.528 -177.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 61.3 mt -58.69 -40.67 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 122.746 0.418 . . . . 73.439999999999998 110.694 178.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -64.27 -41.28 96.99 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 123.894 0.746 . . . . 64.420000000000002 110.91 177.052 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.1 mt -64.5 -36.84 85.49 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.639 0.776 . . . . 62.350000000000001 111.398 176.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.539 HD12 HD11 ' A' ' 63' ' ' LEU . 8.2 mp -69.25 -33.4 73.2 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.477 0.711 . . . . 61.130000000000003 109.939 175.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 65.9 m -71.27 -34.6 70.85 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.176 0.59 . . . . 61.130000000000003 109.642 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 46.3 mmtm -69.09 -56.64 7.09 Favored 'General case' 0 C--N 1.351 0.648 0 C-N-CA 122.975 0.51 . . . . 64.129999999999995 110.266 176.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -57.92 -42.94 85.85 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 124.681 1.192 . . . . 71.310000000000002 111.24 -173.098 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.518 HD22 ' HB3' ' A' ' 38' ' ' GLU . 95.8 mt -73.42 -34.82 65.67 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 123.123 0.569 . . . . 72.540000000000006 111.418 178.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.16 -29.27 68.12 Favored 'General case' 0 N--CA 1.492 1.634 0 C-N-CA 122.965 0.506 . . . . 71.150000000000006 111.35 177.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 22.5 m-85 -74.3 -34.55 63.53 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 115.802 -0.635 . . . . 71.349999999999994 110.063 173.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.15 35.55 53.03 Favored Glycine 0 C--N 1.344 0.995 0 CA-C-N 115.535 -0.757 . . . . 72.109999999999999 112.358 -179.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -98.74 -179.93 4.46 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 123.642 0.777 . . . . 72.409999999999997 110.705 -177.161 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -87.81 143.38 27.17 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 122.936 0.494 . . . . 74.450000000000003 110.04 174.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 7.7 p -76.3 -39.98 35.19 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 N-CA-C 109.341 -0.614 . . . . 75.049999999999997 109.341 171.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.533 HD11 HD11 ' A' ' 50' ' ' ILE . 78.5 mt -140.13 125.95 21.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.692 1.197 . . . . 64.129999999999995 108.883 179.713 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 34.1 t -79.3 87.13 5.0 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 108.784 -0.821 . . . . 74.299999999999997 108.784 173.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 14.5 ptmm? -67.61 -24.58 65.49 Favored 'General case' 0 N--CA 1.475 0.802 0 CA-C-N 115.041 -0.981 . . . . 73.430000000000007 110.384 176.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 . . . . . 0 CA--C 1.554 1.119 0 C-N-CA 123.625 0.77 . . . . 75.310000000000002 110.13 178.708 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.9 tpt . . . . . 0 N--CA 1.477 0.925 0 N-CA-C 109.325 -0.62 . . . . 62.210000000000001 109.325 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -77.65 93.78 1.16 Allowed Glycine 0 C--N 1.343 0.959 0 CA-C-N 115.664 -0.698 . . . . 70.25 111.943 176.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 5.4 p-80 -75.35 111.62 10.82 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 109.433 -0.58 . . . . 63.130000000000003 109.433 175.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 17.4 t-80 -79.64 102.79 9.13 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.321 0.648 . . . . 73.010000000000005 109.437 -177.243 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -72.67 147.96 45.21 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.046 0.538 . . . . 75.140000000000001 111.621 -178.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.0 p-80 -123.53 113.25 18.47 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.531 0.732 . . . . 74.150000000000006 109.791 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -141.18 122.98 15.31 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.726 0.81 . . . . 71.409999999999997 109.201 178.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 79.6 m-70 -136.08 101.24 4.65 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 107.195 -1.409 . . . . 74.209999999999994 107.195 173.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.0 t -105.05 170.86 7.63 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 123.222 0.609 . . . . 71.230000000000004 110.925 -173.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 25.9 p-80 -157.08 143.93 18.43 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 124.773 1.229 . . . . 74.230000000000004 108.288 178.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.6 mpt? -120.94 146.84 46.22 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 109.149 -0.686 . . . . 73.219999999999999 109.149 175.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 49.1 m-20 -67.33 86.42 0.17 Allowed 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.371 1.069 . . . . 72.530000000000001 109.67 -178.456 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.1 m -77.52 111.07 12.86 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.932 0.893 . . . . 74.439999999999998 109.349 -176.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -113.48 157.42 22.0 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.783 0.833 . . . . 74.329999999999998 111.251 -174.191 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -100.14 26.89 6.02 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.093 -0.958 . . . . 74.420000000000002 109.894 179.306 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 79.6 mt -84.0 -164.09 0.88 Allowed 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 124.028 0.931 . . . . 71.439999999999998 111.968 -175.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 1.7 mp -68.72 134.54 30.04 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 C-N-CA 124.715 1.206 . . . . 64.010000000000005 112.042 -163.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 19.1 m80 -87.71 137.28 32.47 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 125.108 1.363 . . . . 63.119999999999997 109.393 179.245 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.404 ' HB ' HG23 ' A' ' 102' ' ' ILE . 51.5 mm -121.76 117.16 51.6 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 107.019 -1.474 . . . . 73.329999999999998 107.019 -178.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.527 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.8 ttmm -90.62 138.0 31.91 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 108.465 -0.939 . . . . 73.530000000000001 108.465 -178.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 85.2 m -105.55 124.61 49.84 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 108.395 -0.965 . . . . 65.450000000000003 108.395 174.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 97.6 mt -117.54 136.26 53.37 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 108.747 -0.834 . . . . 73.150000000000006 108.747 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 75.3 p -68.06 144.68 54.99 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.854 0.862 . . . . 73.430000000000007 110.432 176.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.3 p -126.2 147.84 61.18 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.364 1.066 . . . . 71.430000000000007 109.312 -173.368 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 27.3 Cg_exo -63.94 -28.91 66.81 Favored 'Trans proline' 0 C--N 1.377 2.042 0 C-N-CA 122.537 2.158 . . . . 64.439999999999998 112.033 171.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -87.16 117.23 25.77 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.196 0.999 . . . . 45.420000000000002 108.718 176.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -73.82 -29.78 62.34 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.535 0.734 . . . . 74.450000000000003 112.342 -175.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 3.7 m-20 -74.35 -26.36 60.09 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 122.644 0.378 . . . . 73.109999999999999 110.588 175.715 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -90.11 158.91 17.06 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.411 0.684 . . . . 65.140000000000001 110.856 175.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 22.3 tp -158.67 123.13 4.09 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.335 -0.987 . . . . 64.140000000000001 108.335 168.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -84.22 129.95 34.86 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.041 0.936 . . . . 65.219999999999999 110.636 -174.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -118.57 118.56 32.01 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 124.257 1.023 . . . . 73.040000000000006 108.512 174.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.527 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 60.6 tp -100.88 124.65 46.87 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 109.218 -0.66 . . . . 74.329999999999998 109.218 -172.792 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.0 m -80.92 105.37 12.09 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.453 -0.943 . . . . 74.349999999999994 108.453 178.497 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 57.2 p -91.52 -6.16 52.97 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 112.943 0.719 . . . . 63.039999999999999 112.943 -168.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -97.15 178.02 5.39 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.075 0.95 . . . . 72.099999999999994 109.442 178.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -61.42 -11.72 29.16 Favored Glycine 0 N--CA 1.48 1.613 0 N-CA-C 114.208 0.443 . . . . 61.409999999999997 114.208 -175.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.471 ' HB3' HD22 ' A' ' 109' ' ' LEU . 11.4 mp0 -81.23 89.02 6.01 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.52 1.128 . . . . 72.439999999999998 109.832 175.322 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 26.7 ttt -93.53 136.45 33.8 Favored 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 108.063 -1.088 . . . . 61.340000000000003 108.063 172.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.405 ' HB3' HG11 ' A' ' 115' ' ' VAL . 77.5 mt -68.53 -59.51 3.09 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.933 0.493 . . . . 71.540000000000006 112.106 -167.494 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.534 ' HB2' ' HA ' ' A' ' 81' ' ' ASP . 26.3 mt-30 -117.32 171.08 8.21 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.721 0.808 . . . . 70.310000000000002 109.46 172.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 5.0 t -74.26 149.0 40.97 Favored 'General case' 0 N--CA 1.48 1.042 0 N-CA-C 109.371 -0.603 . . . . 75.239999999999995 109.371 169.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 22.2 ttt85 -72.79 129.54 38.42 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 122.542 0.337 . . . . 73.319999999999993 111.097 -174.53 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 95.66 26.94 11.01 Favored Glycine 0 C--N 1.343 0.931 0 O-C-N 123.852 0.72 . . . . 72.209999999999994 112.044 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 66.3 m -97.48 -177.54 3.84 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.628 0.771 . . . . 73.129999999999995 110.584 176.389 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -94.64 132.47 39.32 Favored 'General case' 0 N--CA 1.471 0.587 0 N-CA-C 108.385 -0.969 . . . . 73.200000000000003 108.385 173.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 51.3 p -70.01 115.71 9.53 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.661 0.785 . . . . 64.030000000000001 110.217 -178.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.1 mt -74.33 102.02 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 N-CA-C 109.017 -0.734 . . . . 74.430000000000007 109.017 -179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 89.7 t -91.65 106.97 18.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 N-CA-C 108.604 -0.888 . . . . 60.340000000000003 108.604 -179.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.508 HG12 ' HB3' ' A' ' 57' ' ' LEU . 66.4 mt -104.39 110.0 29.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.36 0 N-CA-C 108.065 -1.087 . . . . 60.43 108.065 -178.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.509 ' HG2' ' HB3' ' A' ' 76' ' ' SER . 54.1 mtmt -91.34 161.24 15.1 Favored 'General case' 0 N--CA 1.471 0.608 0 N-CA-C 109.247 -0.649 . . . . 71.109999999999999 109.247 177.718 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.451 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 27.6 p30 -63.64 -18.27 63.76 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.0 0.92 . . . . 72.019999999999996 112.307 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -82.85 -27.17 31.0 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.67 0.788 . . . . 62.210000000000001 111.735 177.37 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.445 ' O ' HG13 ' A' ' 58' ' ' ILE . 31.1 m-20 -83.67 77.17 9.91 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.519 0.728 . . . . 72.420000000000002 111.601 -173.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -49.68 -46.31 49.78 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.196 0.998 . . . . 52.420000000000002 112.084 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 38.7 t30 -54.19 -48.02 71.43 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.495 1.118 . . . . 75.230000000000004 111.467 -179.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.508 ' HB3' HG12 ' A' ' 50' ' ' ILE . 83.6 mt -73.6 -28.96 62.1 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 115.525 -0.761 . . . . 73.129999999999995 111.347 -177.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.487 HG22 ' HG2' ' A' ' 65' ' ' GLN . 87.9 mt -70.81 -39.32 75.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.026 0 C-N-CA 123.508 0.723 . . . . 63.43 110.393 178.23 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 66.6 m-80 -66.16 -23.55 66.49 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 122.556 0.342 . . . . 74.439999999999998 111.516 174.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 25.2 m80 -72.05 -10.68 60.11 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 112.869 0.692 . . . . 75.329999999999998 112.869 172.383 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.417 ' OG ' HG12 ' A' ' 116' ' ' ILE . 17.4 m -140.83 105.31 4.87 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 122.841 0.456 . . . . 74.439999999999998 110.513 -177.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.7 tppp? -59.31 -32.8 70.39 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.62 0.768 . . . . 74.450000000000003 110.401 174.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 51.2 tp -60.3 -44.73 95.15 Favored 'General case' 0 C--N 1.356 0.849 0 C-N-CA 123.988 0.915 . . . . 35.450000000000003 110.876 175.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.21 -42.94 99.47 Favored 'General case' 0 C--N 1.357 0.906 0 O-C-N 123.845 0.715 . . . . 61.119999999999997 110.511 -178.419 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.487 ' HG2' HG22 ' A' ' 58' ' ' ILE . 82.8 mt-30 -57.4 -43.89 84.06 Favored 'General case' 0 N--CA 1.472 0.661 0 O-C-N 124.509 1.13 . . . . 72.0 110.862 178.797 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -69.23 -39.29 78.61 Favored 'General case' 0 N--CA 1.477 0.886 0 O-C-N 123.569 0.543 . . . . 53.130000000000003 112.026 179.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.461 HG21 HD21 ' A' ' 77' ' ' LEU . 59.8 mt -64.99 -49.07 81.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 123.435 0.694 . . . . 61.130000000000003 110.658 -178.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 31.7 m-85 -69.88 -27.23 64.64 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.121 0.568 . . . . 73.430000000000007 111.602 179.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 66.6 tp -69.66 -48.52 59.54 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.141 0.576 . . . . 74.430000000000007 110.845 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.415 HE22 HD21 ' A' ' 104' ' ' LEU . 73.8 mt-30 -74.48 -33.37 62.85 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.432 -0.804 . . . . 64.25 111.442 -177.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 52.4 t -142.95 94.18 6.48 Favored Pre-proline 0 CA--C 1.544 0.742 0 N-CA-C 108.759 -0.83 . . . . 74.340000000000003 108.759 -178.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -71.44 -2.01 10.61 Favored 'Trans proline' 0 C--N 1.373 1.851 0 C-N-CA 123.245 2.63 . . . . 75.409999999999997 112.733 174.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.69 -20.24 74.34 Favored Glycine 0 C--N 1.355 1.608 0 N-CA-C 111.687 -0.565 . . . . 74.25 111.687 177.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 85.9 t -65.39 118.3 7.68 Favored 'Isoleucine or valine' 0 C--N 1.354 0.789 0 C-N-CA 123.649 0.78 . . . . 62.229999999999997 109.713 175.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.451 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 40.5 mt-10 -82.15 -41.98 19.69 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.205 1.002 . . . . 44.439999999999998 110.871 -175.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.509 ' HB3' ' HG2' ' A' ' 51' ' ' LYS . 74.6 p -159.14 165.53 33.57 Favored 'General case' 0 N--CA 1.471 0.597 0 CA-C-O 121.632 0.73 . . . . 61.509999999999998 111.999 -175.734 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.461 HD21 HG21 ' A' ' 67' ' ' ILE . 46.5 mt -129.1 127.78 42.16 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 106.905 -1.517 . . . . 72.400000000000006 106.905 176.08 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.495 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.3 ttm -103.32 109.1 20.59 Favored 'General case' 0 C--O 1.242 0.686 0 N-CA-C 108.11 -1.07 . . . . 64.019999999999996 108.11 173.177 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.694 HG13 HD11 ' A' ' 116' ' ' ILE . 13.6 mm -84.29 103.8 11.9 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 N-CA-C 107.046 -1.465 . . . . 71.400000000000006 107.046 177.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.97 -168.74 43.14 Favored Glycine 0 C--O 1.245 0.816 0 N-CA-C 111.617 -0.593 . . . . 71.450000000000003 111.617 177.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.534 ' HA ' ' HB2' ' A' ' 41' ' ' GLN . 1.9 m-20 -76.26 -61.63 1.88 Allowed 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.678 -0.86 . . . . 74.420000000000002 108.678 -178.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -97.04 -14.73 21.42 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 124.112 0.965 . . . . 72.140000000000001 111.361 -178.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 28.3 p90 -134.65 156.25 49.07 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.381 0.512 . . . . 61.100000000000001 112.381 -159.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.61 HD13 HD13 ' A' ' 79' ' ' ILE . 22.6 tp -125.14 114.97 19.73 Favored 'General case' 0 C--O 1.232 0.16 0 C-N-CA 124.889 1.275 . . . . 74.219999999999999 107.921 174.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.495 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 30.8 m -102.44 108.86 20.33 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.452 -0.944 . . . . 70.040000000000006 108.452 -178.063 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 29.0 mm -87.4 136.95 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 N-CA-C 107.908 -1.145 . . . . 70.409999999999997 107.908 -178.07 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 20.1 m-80 -123.07 126.43 47.07 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 108.657 -0.868 . . . . 71.140000000000001 108.657 -179.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.422 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -129.01 167.43 17.48 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.333 0.653 . . . . 74.340000000000003 109.573 177.111 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -59.71 141.94 54.12 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.075 0.95 . . . . 63.210000000000001 110.01 174.099 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.3 ptm180 -54.38 -38.8 66.56 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.513 0.725 . . . . 73.25 112.275 -172.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 45.3 ttp -75.81 -28.13 58.21 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.618 0.767 . . . . 71.319999999999993 111.216 -175.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.405 HG12 HD11 ' A' ' 97' ' ' ILE . 44.3 t -72.04 134.47 29.81 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.233 0 N-CA-C 108.458 -0.942 . . . . 63.439999999999998 108.458 172.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 86.7 m-70 -104.13 160.78 14.57 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 123.149 0.579 . . . . 75.409999999999997 110.929 -176.072 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -77.94 -13.78 59.76 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.471 1.109 . . . . 72.430000000000007 113.547 -175.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -64.56 -28.36 69.59 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 123.28 0.632 . . . . 75.209999999999994 111.919 -171.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 49.2 m -95.24 -23.93 17.02 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.779 0.832 . . . . 72.519999999999996 111.546 178.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.405 HD11 HG12 ' A' ' 92' ' ' VAL . 50.7 mt -89.98 -48.93 14.13 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 123.813 0.845 . . . . 73.549999999999997 111.294 -168.61 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 9.7 mtpm? -51.62 -55.51 29.05 Favored Pre-proline 0 N--CA 1.487 1.395 0 CA-C-O 117.428 -1.272 . . . . 74.209999999999994 113.282 -174.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -59.85 -38.19 81.33 Favored 'Trans proline' 0 C--N 1.396 3.049 0 CA-C-N 121.577 1.599 . . . . 63.100000000000001 112.314 -175.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -70.45 -48.03 57.86 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.049 0.54 . . . . 61.240000000000002 110.523 -175.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 13.1 mt -69.95 -45.23 77.38 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 123.49 0.716 . . . . 63.210000000000001 111.186 -178.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.404 HG23 ' HB ' ' A' ' 19' ' ' ILE . 58.1 mt -58.41 -37.4 63.63 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 C-N-CA 123.067 0.547 . . . . 74.420000000000002 110.813 177.292 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 19.0 t70 -67.84 -45.77 73.7 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 123.687 0.617 . . . . 60.509999999999998 110.279 175.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.415 HD21 HE22 ' A' ' 70' ' ' GLN . 84.5 mt -60.11 -33.74 72.53 Favored 'General case' 0 N--CA 1.492 1.673 0 C-N-CA 123.867 0.867 . . . . 71.099999999999994 111.588 177.466 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 7.5 mp -74.05 -35.34 64.3 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.171 0.988 . . . . 65.049999999999997 110.654 178.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 85.5 m -72.07 -31.19 65.87 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 109.293 -0.632 . . . . 43.450000000000003 109.293 178.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.535 ' HA ' ' HE2' ' A' ' 107' ' ' LYS . 10.1 mmpt? -73.32 -52.96 12.02 Favored 'General case' 0 C--N 1.353 0.727 0 C-N-CA 123.932 0.893 . . . . 62.520000000000003 111.101 175.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 29.0 tt0 -55.7 -53.14 60.3 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.783 0.833 . . . . 74.439999999999998 111.043 -178.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.471 HD22 ' HB3' ' A' ' 38' ' ' GLU . 78.7 mt -74.12 -10.8 59.98 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 114.844 -1.071 . . . . 73.420000000000002 111.417 -176.197 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.84 -27.4 62.87 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 122.706 0.402 . . . . 45.32 110.845 170.226 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 7.5 m-85 -79.62 -52.04 8.49 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 107.51 -1.293 . . . . 75.439999999999998 107.51 168.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.82 -8.6 75.16 Favored Glycine 0 C--N 1.354 1.582 0 N-CA-C 115.838 1.095 . . . . 75.150000000000006 115.838 163.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -69.18 -70.46 0.27 Allowed 'General case' 0 N--CA 1.476 0.849 0 CA-C-N 117.669 0.734 . . . . 52.020000000000003 111.108 -176.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -134.1 126.09 29.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.122 0.569 . . . . 72.219999999999999 110.762 -171.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.405 HG11 ' HB3' ' A' ' 40' ' ' LEU . 3.9 p -75.35 -43.94 42.64 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 N-CA-C 107.997 -1.112 . . . . 62.340000000000003 107.997 158.559 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.694 HD11 HG13 ' A' ' 79' ' ' ILE . 29.4 mt -132.78 142.08 43.3 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 C-N-CA 125.326 1.45 . . . . 63.409999999999997 107.218 170.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.3 p -57.61 118.92 5.73 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.056 0.942 . . . . 55.530000000000001 110.972 177.241 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -73.98 84.51 1.76 Allowed 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 122.091 0.948 . . . . 73.310000000000002 110.874 178.4 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.8 pt-20 . . . . . 0 CA--C 1.555 1.153 0 C-N-CA 124.295 1.038 . . . . 64.230000000000004 109.747 -179.274 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptt? . . . . . 0 N--CA 1.484 1.236 0 N-CA-C 110.218 -0.289 . . . . 72.230000000000004 110.218 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 97.19 77.54 1.36 Allowed Glycine 0 C--N 1.347 1.148 0 O-C-N 123.314 0.384 . . . . 64.010000000000005 112.455 175.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -80.07 80.38 6.49 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 109.246 -0.65 . . . . 72.319999999999993 109.246 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . 0.434 ' HD2' ' HB2' ' A' ' 6' ' ' HIS . 38.0 p-80 -87.97 136.52 32.93 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.463 1.105 . . . . 64.140000000000001 110.738 -176.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 13.2 p-80 -85.31 61.97 7.2 Favored 'General case' 0 N--CA 1.481 1.125 0 CA-C-O 121.893 0.854 . . . . 75.25 110.964 177.407 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.434 ' HB2' ' HD2' ' A' ' 4' ' ' HIS . 70.1 m-70 -128.79 112.28 14.0 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.215 1.006 . . . . 61.340000000000003 108.672 175.56 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.429 ' CE1' ' HG ' ' A' ' 9' ' ' SER . 37.5 t-80 -130.15 135.71 48.49 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.548 1.139 . . . . 75.310000000000002 108.97 -179.221 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.1 p-80 -160.78 78.42 0.61 Allowed 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 123.76 0.824 . . . . 53.409999999999997 109.938 178.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.429 ' HG ' ' CE1' ' A' ' 7' ' ' HIS . 60.2 p -100.6 79.01 2.04 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 123.459 0.703 . . . . 60.439999999999998 110.43 -179.483 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 62.3 t60 -88.93 123.57 33.41 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.235 0.614 . . . . 73.430000000000007 109.487 177.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.1 ptt? -74.24 111.34 9.32 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 109.17 -0.678 . . . . 71.25 109.17 174.107 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -74.36 87.6 2.03 Favored 'General case' 0 N--CA 1.471 0.582 0 N-CA-C 108.291 -1.003 . . . . 70.430000000000007 108.291 173.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 32.2 t -72.25 77.65 0.99 Allowed 'General case' 0 CA--C 1.54 0.594 0 CA-C-O 121.949 0.88 . . . . 73.25 109.524 -177.81 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 86.6 mm-40 -121.27 86.46 2.58 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 106.934 -1.506 . . . . 72.25 106.934 178.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.0 ttt180 -83.99 119.76 25.31 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 116.017 -0.538 . . . . 74.430000000000007 109.664 -175.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -147.67 140.98 25.22 Favored 'General case' 0 C--O 1.246 0.882 0 N-CA-C 108.997 -0.742 . . . . 72.239999999999995 108.997 173.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.541 HD12 ' HA ' ' A' ' 106' ' ' THR . 74.7 mt -69.62 100.14 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.434 0 CA-C-N 115.039 -0.982 . . . . 73.450000000000003 108.941 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.454 ' H ' ' HB3' ' A' ' 36' ' ' ASP . 48.2 m80 -68.32 120.54 14.61 Favored 'General case' 0 C--O 1.245 0.829 0 C-N-CA 124.293 1.037 . . . . 71.239999999999995 110.848 -174.371 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 50.4 mm -118.19 123.71 72.03 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.575 0 N-CA-C 108.079 -1.082 . . . . 73.519999999999996 108.079 -173.127 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.526 ' HE3' HD21 ' A' ' 22' ' ' LEU . 56.6 tptt -96.78 112.27 24.09 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.684 1.194 . . . . 75.120000000000005 109.108 -177.433 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.452 HG21 ' HE3' ' A' ' 98' ' ' LYS . 59.8 m -92.49 113.47 25.76 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 108.847 -0.797 . . . . 74.450000000000003 108.847 -178.627 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.526 HD21 ' HE3' ' A' ' 20' ' ' LYS . 95.4 mt -122.26 138.01 54.64 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.625 1.17 . . . . 64.230000000000004 109.591 -171.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 79.4 p -81.02 147.81 30.01 Favored 'General case' 0 C--O 1.24 0.56 0 O-C-N 124.073 0.858 . . . . 64.109999999999999 110.553 -178.431 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 36.6 p -125.38 158.0 65.76 Favored Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 124.136 0.974 . . . . 75.030000000000001 109.373 -174.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.13 -32.1 30.79 Favored 'Trans proline' 0 C--N 1.389 2.679 0 C-N-CA 123.289 2.66 . . . . 70.230000000000004 113.684 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -100.71 121.46 41.7 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 108.918 -0.771 . . . . 74.209999999999994 108.918 173.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -73.82 -15.37 61.18 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.112 0.565 . . . . 74.010000000000005 111.303 178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.436 ' O ' ' HA ' ' A' ' 87' ' ' ASN . 13.2 m120 -71.9 -19.05 61.99 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 122.655 0.382 . . . . 52.450000000000003 110.609 170.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -102.41 159.7 15.19 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.56 1.144 . . . . 71.319999999999993 110.082 172.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.0 tp -160.28 120.91 2.96 Favored 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 109.14 -0.689 . . . . 71.439999999999998 109.14 176.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 4.9 ttmp? -82.44 120.75 25.86 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.044 0.538 . . . . 73.299999999999997 111.131 -176.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -105.24 111.86 24.76 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 108.381 -0.97 . . . . 71.140000000000001 108.381 169.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.521 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 59.5 tp -108.83 128.28 54.76 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.669 0.787 . . . . 62.310000000000002 109.665 -171.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 p -80.5 104.53 11.1 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.909 -0.774 . . . . 74.310000000000002 108.909 179.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 16.5 p -101.11 -6.74 23.92 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.743 0.817 . . . . 55.329999999999998 111.302 -178.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.454 ' HB3' ' H ' ' A' ' 18' ' ' HIS . 8.0 p-10 -69.44 -37.7 77.48 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.167 0.587 . . . . 75.430000000000007 110.316 177.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 133.31 -12.5 4.96 Favored Glycine 0 C--N 1.349 1.292 0 C-N-CA 123.371 0.51 . . . . 71.129999999999995 113.031 178.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.519 ' HG2' ' HB3' ' A' ' 109' ' ' LEU . 9.6 tp10 -78.04 149.03 34.06 Favored 'General case' 0 C--N 1.356 0.869 0 CA-C-N 117.567 0.683 . . . . 74.209999999999994 109.965 -178.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 7.5 tpt -111.77 142.66 43.85 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.222 0.609 . . . . 72.439999999999998 109.992 -170.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.679 HD23 HD21 ' A' ' 109' ' ' LEU . 89.8 mt -86.0 -44.42 12.35 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.409 0.684 . . . . 74.450000000000003 111.378 -177.232 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.434 ' HG3' ' H ' ' A' ' 42' ' ' THR . 6.9 tp60 -135.17 -178.0 4.9 Favored 'General case' 0 CA--C 1.561 1.376 0 N-CA-C 109.194 -0.669 . . . . 64.430000000000007 109.194 -177.278 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.434 ' H ' ' HG3' ' A' ' 41' ' ' GLN . 5.3 m -74.8 -1.01 20.18 Favored 'General case' 0 CA--C 1.568 1.651 0 N-CA-C 114.608 1.336 . . . . 70.109999999999999 114.608 -160.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.47 67.91 0.38 Allowed 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 124.427 1.091 . . . . 71.420000000000002 108.648 -173.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 153.92 43.49 0.02 OUTLIER Glycine 0 C--N 1.342 0.872 0 CA-C-N 115.195 -0.911 . . . . 74.340000000000003 112.236 178.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 16.2 t -129.38 176.92 7.56 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.384 0.674 . . . . 40.229999999999997 109.817 178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -99.28 -176.31 3.26 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.301 1.041 . . . . 71.439999999999998 110.185 177.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 47.5 m -73.49 92.88 1.93 Allowed 'General case' 0 CA--C 1.545 0.785 0 N-CA-C 109.355 -0.609 . . . . 71.430000000000007 109.355 173.294 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.561 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 46.9 mt -75.35 97.87 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 108.758 -0.83 . . . . 65.400000000000006 108.758 178.716 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.4 t -86.83 107.27 16.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 N-CA-C 108.017 -1.105 . . . . 74.329999999999998 108.017 -176.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 67.6 mt -102.59 108.4 24.02 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 107.884 -1.154 . . . . 72.109999999999999 107.884 179.519 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.2 mtmp? -95.66 155.96 16.53 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 123.195 0.598 . . . . 65.420000000000002 109.66 -176.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.442 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 34.5 p30 -60.47 -18.87 54.27 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.563 0.745 . . . . 72.420000000000002 112.364 -178.772 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 51.5 p -77.56 -41.27 39.53 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.774 0.83 . . . . 61.210000000000001 111.262 177.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -86.69 79.75 8.77 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 123.502 0.721 . . . . 73.540000000000006 110.552 -171.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -66.53 -22.82 66.17 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 115.28 -0.873 . . . . 74.319999999999993 112.21 -173.691 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 25.1 p-10 -57.5 -46.88 83.24 Favored 'General case' 0 CA--C 1.55 0.947 0 CA-C-O 121.052 0.453 . . . . 73.010000000000005 110.377 178.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 89.3 mt -73.2 -35.65 66.38 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.662 0.785 . . . . 63.140000000000001 110.523 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.402 HG22 ' HG2' ' A' ' 65' ' ' GLN . 72.1 mt -61.27 -42.54 93.89 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.891 0 C-N-CA 124.337 1.055 . . . . 51.130000000000003 110.283 177.24 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.433 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 83.1 m-20 -69.45 -29.19 66.83 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.159 0.584 . . . . 72.540000000000006 111.875 177.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.565 ' HB3' HG23 ' A' ' 116' ' ' ILE . 24.7 m80 -73.9 -33.14 63.88 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.142 0.577 . . . . 65.120000000000005 111.525 175.646 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 34.0 p -110.97 92.24 3.97 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 108.798 -0.816 . . . . 71.450000000000003 108.798 176.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -57.46 -23.4 49.61 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 123.718 0.807 . . . . 71.349999999999994 111.352 -175.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.405 HD11 HD12 ' A' ' 105' ' ' LEU . 62.4 tp -58.12 -46.73 85.09 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.062 1.345 . . . . 72.200000000000003 110.872 171.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -62.72 -39.27 93.52 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.939 0.896 . . . . 71.140000000000001 110.707 -178.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.433 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 95.6 mt-30 -55.06 -47.84 74.31 Favored 'General case' 0 N--CA 1.483 1.196 0 O-C-N 123.651 0.594 . . . . 72.329999999999998 109.827 175.179 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -65.61 -45.31 83.64 Favored 'General case' 0 CA--C 1.548 0.89 0 CA-C-N 115.135 -0.939 . . . . 74.099999999999994 112.845 -179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 69.2 mt -65.09 -49.1 81.09 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 123.112 0.565 . . . . 64.510000000000005 110.663 -176.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 35.7 m-85 -68.24 -30.12 69.1 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 116.107 -0.497 . . . . 75.409999999999997 111.372 179.822 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 41.0 tp -73.32 -46.99 46.17 Favored 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 123.107 0.563 . . . . 64.340000000000003 111.679 178.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.432 HE22 HD21 ' A' ' 104' ' ' LEU . 77.7 mt-30 -83.27 -17.42 42.65 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.316 0.647 . . . . 53.140000000000001 111.594 -173.794 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 51.6 t -141.96 105.58 5.73 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 123.352 0.661 . . . . 63.310000000000002 109.604 172.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -72.45 -8.53 22.77 Favored 'Trans proline' 0 C--N 1.374 1.901 0 C-N-CA 122.949 2.433 . . . . 73.409999999999997 112.803 176.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.572 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -76.61 -21.9 73.78 Favored Glycine 0 C--N 1.345 1.037 0 CA-C-N 116.57 -0.286 . . . . 71.010000000000005 113.29 -178.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 44.2 t -72.53 122.68 25.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.798 0 C-N-CA 122.989 0.516 . . . . 63.219999999999999 109.673 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.442 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 11.1 pt-20 -93.04 -33.77 13.97 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.755 0.822 . . . . 72.349999999999994 111.23 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 58.9 p -161.9 160.29 27.76 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.459 0.647 . . . . 63.439999999999998 112.023 -176.574 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.411 HD22 HD12 ' A' ' 86' ' ' ILE . 40.7 mt -121.08 139.23 53.6 Favored 'General case' 0 N--CA 1.468 0.467 0 N-CA-C 107.155 -1.424 . . . . 74.120000000000005 107.155 174.671 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.557 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 48.6 ttm -113.06 109.22 18.47 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 107.215 -1.402 . . . . 72.400000000000006 107.215 173.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.615 HG21 HG11 ' A' ' 115' ' ' VAL . 39.8 mm -92.49 127.18 44.83 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 109.342 -0.614 . . . . 72.209999999999994 109.342 -176.138 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -114.22 175.61 16.38 Favored Glycine 0 C--O 1.241 0.566 0 N-CA-C 109.677 -1.369 . . . . 41.240000000000002 109.677 166.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.413 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 23.5 m-20 -72.71 -44.61 61.5 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 121.582 0.706 . . . . 65.230000000000004 110.468 177.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -104.38 -39.51 6.42 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 125.014 1.326 . . . . 65.200000000000003 110.933 -174.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 18.1 p90 -111.21 155.58 22.73 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.292 0.637 . . . . 53.310000000000002 111.201 -175.467 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.46 HD21 HD11 ' A' ' 86' ' ' ILE . 54.3 tp -120.79 150.45 40.99 Favored 'General case' 0 N--CA 1.473 0.683 0 N-CA-C 107.425 -1.324 . . . . 74.430000000000007 107.425 171.209 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.557 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 50.7 m -141.37 109.46 5.81 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.218 0.607 . . . . 43.450000000000003 109.76 175.798 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.499 HG13 HD13 ' A' ' 101' ' ' ILE . 29.5 mm -88.76 139.53 17.23 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 N-CA-C 109.242 -0.651 . . . . 61.409999999999997 109.242 -178.685 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.436 ' HA ' ' O ' ' A' ' 28' ' ' ASN . 33.5 m-80 -118.35 133.82 55.56 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.454 0.702 . . . . 74.319999999999993 109.571 175.554 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.486 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -128.11 168.74 14.95 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.585 0.754 . . . . 71.319999999999993 109.978 -178.832 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.408 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 14.1 t70 -72.95 149.5 43.31 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 123.274 0.63 . . . . 71.549999999999997 110.179 173.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 30.7 ptt180 -50.14 -41.04 48.09 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 124.653 1.181 . . . . 65.439999999999998 114.184 -172.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 20.0 ptp -83.41 -18.03 40.14 Favored 'General case' 0 N--CA 1.491 1.607 0 C-N-CA 122.752 0.421 . . . . 75.340000000000003 111.75 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.572 HG11 ' HA3' ' A' ' 73' ' ' GLY . 27.4 t -81.46 127.65 39.39 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 123.068 0.547 . . . . 72.439999999999998 109.545 -171.592 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 86.0 m-70 -86.8 130.68 34.37 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.785 0.834 . . . . 74.209999999999994 110.601 -169.75 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.486 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 45.4 m95 -59.16 -31.41 68.96 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.507 0.723 . . . . 71.310000000000002 112.141 178.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -61.35 -26.19 67.66 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 122.767 0.427 . . . . 73.349999999999994 111.445 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 34.7 t -86.99 -18.73 29.97 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 123.698 0.799 . . . . 44.32 111.367 179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.5 HD11 HG12 ' A' ' 92' ' ' VAL . 10.9 mt -104.09 -44.16 8.86 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.348 0 C-N-CA 123.043 0.537 . . . . 73.409999999999997 111.586 -170.51 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.452 ' HE3' HG21 ' A' ' 21' ' ' THR . 54.5 mtpt -52.91 -52.18 67.46 Favored Pre-proline 0 N--CA 1.491 1.595 0 C-N-CA 124.963 1.305 . . . . 74.239999999999995 113.706 -172.636 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 20.8 Cg_endo -56.5 -40.07 87.0 Favored 'Trans proline' 0 C--N 1.393 2.919 0 C-N-CA 121.909 1.74 . . . . 74.239999999999995 112.049 -178.31 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.4 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 10.8 mm-40 -61.84 -53.76 51.44 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-N 114.79 -1.096 . . . . 75.310000000000002 110.03 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.499 HD13 HG13 ' A' ' 86' ' ' ILE . 48.2 mt -61.93 -51.06 77.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.943 0 C-N-CA 124.077 0.951 . . . . 75.109999999999999 111.833 -176.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 83.2 mt -58.56 -40.17 77.99 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.164 0 C-N-CA 123.308 0.643 . . . . 73.299999999999997 110.824 -177.904 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 13.2 t70 -66.99 -42.51 84.9 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.944 0.498 . . . . 63.240000000000002 110.74 178.352 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.432 HD21 HE22 ' A' ' 70' ' ' GLN . 90.7 mt -65.79 -35.57 81.08 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 124.163 0.985 . . . . 63.509999999999998 111.757 178.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.405 HD12 HD11 ' A' ' 63' ' ' LEU . 6.5 mp -62.36 -35.94 80.69 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.687 0.795 . . . . 63.310000000000002 109.95 174.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.541 ' HA ' HD12 ' A' ' 17' ' ' ILE . 26.3 m -74.26 -29.83 61.85 Favored 'General case' 0 CA--C 1.553 1.058 0 C-N-CA 123.073 0.549 . . . . 63.240000000000002 110.054 -179.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -65.53 -52.41 52.81 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.456 0.702 . . . . 65.120000000000005 110.31 174.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -66.88 -52.62 41.24 Favored 'General case' 0 N--CA 1.48 1.049 0 CA-C-N 115.306 -0.861 . . . . 73.420000000000002 111.744 -174.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.679 HD21 HD23 ' A' ' 40' ' ' LEU . 95.4 mt -67.56 -18.03 64.86 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.551 -0.75 . . . . 61.130000000000003 111.528 -174.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -67.33 -19.4 65.45 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 123.717 0.807 . . . . 71.420000000000002 112.032 174.017 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -74.73 -29.23 61.1 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 122.992 0.517 . . . . 62.32 110.434 173.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.97 28.04 63.32 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.947 -0.57 . . . . 74.329999999999998 112.85 -177.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -115.81 -178.65 3.44 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.216 1.006 . . . . 62.119999999999997 110.064 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -70.14 169.47 13.49 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.189 0.596 . . . . 62.340000000000003 110.336 172.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.615 HG11 HG21 ' A' ' 79' ' ' ILE . 7.1 p -67.54 -36.13 75.31 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 123.896 0.878 . . . . 63.329999999999998 109.707 175.728 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.565 HG23 ' HB3' ' A' ' 60' ' ' HIS . 83.8 mt -98.96 137.73 25.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 C-N-CA 124.644 1.178 . . . . 71.219999999999999 107.913 173.248 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 64.7 m -59.42 105.33 0.34 Allowed 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 122.855 0.462 . . . . 65.319999999999993 109.796 175.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 55.6 tttp -63.33 -50.68 69.05 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.366 1.066 . . . . 74.25 110.839 -177.147 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 . . . . . 0 C--O 1.254 1.297 0 C-N-CA 125.116 1.366 . . . . 65.319999999999993 110.938 -177.182 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.5 ptp . . . . . 0 N--CA 1.48 1.028 0 CA-C-O 120.394 0.14 . . . . 73.430000000000007 110.985 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -76.48 75.18 1.64 Allowed Glycine 0 C--N 1.353 1.497 0 N-CA-C 112.191 -0.363 . . . . 74.109999999999999 112.191 178.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 44.6 t-80 -71.79 120.13 16.94 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.875 0.87 . . . . 63.200000000000003 109.665 178.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 66.1 m80 -128.58 92.56 3.44 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.332 0.653 . . . . 70.519999999999996 110.826 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -140.23 131.47 26.58 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 124.824 1.25 . . . . 72.540000000000006 108.721 168.655 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 23.4 p-80 -154.19 162.84 40.92 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 122.933 0.493 . . . . 71.120000000000005 110.796 179.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 47.3 t60 -164.66 94.16 0.68 Allowed 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.329 0.652 . . . . 50.219999999999999 110.456 178.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 29.7 p-80 -86.61 129.06 35.01 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.259 0.624 . . . . 73.510000000000005 109.515 170.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 67.1 m -158.47 109.11 2.11 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.988 0.915 . . . . 51.149999999999999 109.355 179.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 40.8 p-80 -105.61 102.54 11.99 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.345 -0.613 . . . . 72.430000000000007 109.345 174.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.8 ttt -79.21 84.93 5.12 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 108.763 -0.828 . . . . 73.230000000000004 108.763 175.251 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -70.59 122.81 20.45 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.302 0.641 . . . . 61.229999999999997 109.592 175.142 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 33.2 t -70.82 154.2 42.05 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 123.372 0.669 . . . . 70.299999999999997 110.375 175.479 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -133.42 152.78 51.95 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 108.48 -0.933 . . . . 74.200000000000003 108.48 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 60.0 ttt180 62.18 79.38 0.26 Allowed 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 124.996 1.318 . . . . 72.129999999999995 109.775 -169.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.529 HD23 ' H ' ' A' ' 16' ' ' LEU . 1.9 pt? -110.65 127.64 55.36 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 114.387 -1.279 . . . . 72.310000000000002 107.735 174.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 65.7 mt -76.6 113.08 15.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.038 0.535 . . . . 62.009999999999998 110.747 -170.123 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 76.7 m80 -77.31 112.92 14.53 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.254 1.021 . . . . 72.540000000000006 110.627 -175.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.448 ' HB ' HG23 ' A' ' 102' ' ' ILE . 50.1 mm -121.63 119.24 58.31 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 106.69 -1.596 . . . . 72.340000000000003 106.69 179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -112.25 130.88 55.78 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 107.843 -1.169 . . . . 73.219999999999999 107.843 178.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 22.1 m -111.01 112.58 24.5 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.469 -0.567 . . . . 71.420000000000002 109.469 -175.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 91.8 mt -97.62 139.67 33.17 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 123.396 0.678 . . . . 70.109999999999999 109.95 177.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 64.5 p -84.65 150.79 24.9 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 123.765 0.826 . . . . 74.450000000000003 110.223 -176.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 54.4 p -126.66 145.85 54.8 Favored Pre-proline 0 CA--C 1.551 0.982 0 C-N-CA 123.589 0.756 . . . . 63.140000000000001 109.587 -174.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_exo -52.74 -41.08 71.99 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 123.203 2.602 . . . . 50.329999999999998 113.246 178.406 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 14.6 p-10 -73.53 111.9 9.1 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.2 0.6 . . . . 60.439999999999998 109.858 172.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -71.99 -16.99 62.08 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 124.239 1.016 . . . . 65.0 112.368 -172.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -89.73 6.75 40.13 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.737 0.815 . . . . 61.119999999999997 111.5 -178.034 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -135.47 159.34 41.9 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.391 1.077 . . . . 61.539999999999999 109.353 174.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 38.9 tp -156.86 127.55 6.66 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 109.314 -0.625 . . . . 74.519999999999996 109.314 177.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -90.54 114.7 26.97 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 123.367 0.667 . . . . 72.230000000000004 111.258 -173.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 44.6 m-85 -103.19 125.35 49.83 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.748 1.219 . . . . 74.510000000000005 108.2 170.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.5 tp -130.71 136.69 49.02 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.501 0.72 . . . . 75.409999999999997 109.34 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.4 m -91.05 112.41 24.3 Favored 'General case' 0 C--O 1.239 0.539 0 N-CA-C 108.77 -0.826 . . . . 72.510000000000005 108.77 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.2 p -75.9 -5.74 47.56 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.249 0.62 . . . . 64.439999999999998 112.423 -174.497 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 38.1 m-20 -71.0 -31.26 67.74 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.174 0.59 . . . . 65.430000000000007 110.141 169.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 103.96 36.28 3.23 Favored Glycine 0 C--N 1.344 1.01 0 CA-C-N 115.475 -0.784 . . . . 72.540000000000006 111.986 -174.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.404 ' HB3' HD22 ' A' ' 109' ' ' LEU . 22.7 mm-40 -83.71 81.87 8.57 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-O 121.545 0.688 . . . . 74.329999999999998 109.449 178.926 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.412 ' HG2' ' O ' ' A' ' 41' ' ' GLN . 52.2 ttm -74.67 133.14 42.13 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 114.97 -1.013 . . . . 64.310000000000002 109.871 -179.583 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.54 HD11 ' HB2' ' A' ' 84' ' ' LEU . 75.4 mt -78.12 -57.67 3.66 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.238 0.615 . . . . 72.519999999999996 110.494 -174.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.523 ' HB2' ' HA ' ' A' ' 81' ' ' ASP . 10.1 mm100 -103.97 -157.84 0.63 Allowed 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 124.387 1.075 . . . . 73.349999999999994 109.143 -177.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 90.5 m -86.37 147.65 25.94 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.935 0.894 . . . . 73.409999999999997 109.012 171.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.3 tpt180 -61.17 118.17 6.49 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-N 118.671 0.669 . . . . 75.140000000000001 110.468 -179.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 99.82 18.17 23.54 Favored Glycine 0 C--N 1.345 1.052 0 CA-C-O 119.708 -0.496 . . . . 64.510000000000005 113.219 -179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 73.7 m -78.71 172.62 13.46 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 117.396 0.598 . . . . 73.530000000000001 111.779 177.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 11.2 mmpt? -87.82 154.07 20.84 Favored 'General case' 0 C--O 1.241 0.652 0 C-N-CA 124.103 0.961 . . . . 73.540000000000006 110.329 -179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.4 m -77.65 91.9 4.06 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.571 0.748 . . . . 52.509999999999998 109.63 177.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.438 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 64.5 mt -73.47 109.15 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.863 0 C-N-CA 124.311 1.044 . . . . 65.25 109.678 -175.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.2 t -87.04 110.06 19.95 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 N-CA-C 109.225 -0.657 . . . . 71.150000000000006 109.225 -176.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.416 HG23 ' HB2' ' A' ' 57' ' ' LEU . 76.0 mt -106.61 107.83 23.67 Favored 'Isoleucine or valine' 0 C--O 1.235 0.31 0 N-CA-C 107.556 -1.275 . . . . 65.409999999999997 107.556 174.361 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 53.2 mtmt -92.37 165.26 13.16 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 109.68 -0.489 . . . . 74.299999999999997 109.68 -177.712 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -64.79 -24.46 67.56 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.507 0.723 . . . . 75.409999999999997 111.759 178.184 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.0 t -79.48 -22.88 43.47 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.403 0.681 . . . . 74.239999999999995 110.672 176.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -90.16 63.18 5.73 Favored 'General case' 0 C--N 1.354 0.771 0 C-N-CA 123.604 0.762 . . . . 63.219999999999999 109.894 177.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.478 ' HA ' HD12 ' A' ' 58' ' ' ILE . 38.1 tt0 -65.45 -23.82 67.02 Favored 'General case' 0 CA--C 1.546 0.803 0 CA-C-N 115.897 -0.592 . . . . 75.349999999999994 110.466 -179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 5.1 p-10 -61.67 -40.65 95.7 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.092 0.957 . . . . 62.310000000000002 111.278 175.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.416 ' HB2' HG23 ' A' ' 50' ' ' ILE . 96.0 mt -71.86 -41.38 68.16 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.273 0.629 . . . . 74.099999999999994 110.007 176.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.478 HD12 ' HA ' ' A' ' 55' ' ' GLU . 79.9 mt -59.2 -37.76 70.48 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.088 0 C-N-CA 124.356 1.062 . . . . 73.120000000000005 111.103 179.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 15.5 m120 -58.47 -34.43 70.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.48 0.712 . . . . 74.25 111.699 175.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 53.0 m80 -94.95 13.71 24.07 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.031 0.932 . . . . 75.439999999999998 111.525 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 17.4 m -138.4 96.51 3.18 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.726 0.81 . . . . 53.009999999999998 109.793 -177.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 58.9 tptt -55.73 -44.89 77.94 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.549 1.139 . . . . 73.030000000000001 112.388 -177.731 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.583 ' HB3' HG23 ' A' ' 115' ' ' VAL . 51.1 tp -61.1 -39.52 90.26 Favored 'General case' 0 N--CA 1.479 1.0 0 CA-C-N 115.355 -0.839 . . . . 75.349999999999994 111.464 177.39 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.65 -43.52 96.52 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.906 0.483 . . . . 73.030000000000001 111.396 -179.478 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 89.5 mt-30 -56.29 -47.56 78.41 Favored 'General case' 0 N--CA 1.476 0.831 0 O-C-N 123.993 0.808 . . . . 53.32 110.612 177.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.55 ' HB3' HD22 ' A' ' 104' ' ' LEU . 27.2 mm-40 -62.14 -44.98 95.43 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.754 0.822 . . . . 65.340000000000003 113.09 177.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.422 HG21 HD21 ' A' ' 77' ' ' LEU . 81.3 mt -65.13 -49.93 76.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 123.255 0.622 . . . . 75.209999999999994 110.863 -177.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -69.56 -26.21 64.38 Favored 'General case' 0 N--CA 1.479 1.0 0 N-CA-C 111.988 0.366 . . . . 74.099999999999994 111.988 179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.8 tp -72.5 -60.09 2.4 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 122.993 0.517 . . . . 63.439999999999998 111.268 178.442 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -81.35 -21.57 39.03 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.765 -0.652 . . . . 70.219999999999999 111.398 -171.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.521 ' SG ' HG23 ' A' ' 97' ' ' ILE . 60.1 m -124.44 92.73 47.6 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 123.612 0.765 . . . . 74.239999999999995 109.472 178.277 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.03 -10.75 26.51 Favored 'Trans proline' 0 C--N 1.373 1.827 0 C-N-CA 123.004 2.47 . . . . 73.129999999999995 113.337 -177.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.441 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -100.6 46.63 1.32 Allowed Glycine 0 C--N 1.348 1.244 0 C-N-CA 122.759 0.219 . . . . 32.210000000000001 112.721 178.769 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 94.8 t -122.26 125.34 72.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 123.742 0.817 . . . . 74.319999999999993 109.187 170.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 -87.82 -42.43 12.56 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.76 0.424 . . . . 75.150000000000006 111.158 -177.641 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.1 t -152.98 165.51 35.33 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.061 0.458 . . . . 52.229999999999997 111.272 -172.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.422 HD21 HG21 ' A' ' 67' ' ' ILE . 79.1 mt -128.62 130.02 46.7 Favored 'General case' 0 N--CA 1.462 0.167 0 C-N-CA 124.61 1.164 . . . . 71.25 108.143 175.851 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.542 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.7 ttm -107.72 101.88 11.15 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.53 -1.285 . . . . 61.399999999999999 107.53 174.801 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.438 ' HB ' ' HB ' ' A' ' 48' ' ' ILE . 45.8 mm -83.55 100.69 7.31 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 N-CA-C 108.221 -1.029 . . . . 63.340000000000003 108.221 -176.061 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -83.06 172.06 51.09 Favored Glycine 0 C--O 1.248 0.973 0 N-CA-C 109.715 -1.354 . . . . 72.319999999999993 109.715 174.412 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.523 ' HA ' ' HB2' ' A' ' 41' ' ' GLN . 10.9 p-10 -70.07 -51.76 29.29 Favored 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 110.122 -0.325 . . . . 74.109999999999999 110.122 -178.415 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -99.58 -39.82 8.12 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.229 0.612 . . . . 70.329999999999998 109.847 175.793 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 45.7 p90 -95.76 163.03 13.35 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 123.522 0.729 . . . . 74.349999999999994 111.67 -170.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.54 ' HB2' HD11 ' A' ' 40' ' ' LEU . 67.3 tp -130.03 113.42 14.53 Favored 'General case' 0 N--CA 1.468 0.431 0 N-CA-C 108.747 -0.834 . . . . 64.439999999999998 108.747 175.255 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.542 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 51.3 m -105.69 109.93 22.06 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 109.207 -0.664 . . . . 63.25 109.207 -179.774 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.419 HG13 HG21 ' A' ' 101' ' ' ILE . 28.9 mm -87.83 133.76 29.65 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.355 0 N-CA-C 107.77 -1.196 . . . . 74.310000000000002 107.77 179.587 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 21.9 m-80 -114.44 134.0 55.32 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 123.417 0.687 . . . . 72.019999999999996 109.32 -177.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.457 ' NZ ' HD12 ' A' ' 97' ' ' ILE . 0.0 OUTLIER -140.07 174.6 10.35 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 121.432 0.634 . . . . 75.019999999999996 111.426 175.285 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -86.49 147.73 25.85 Favored 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 114.917 -1.038 . . . . 70.030000000000001 109.08 175.352 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.6 ptt180 -76.81 -1.94 30.75 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 112.826 0.676 . . . . 75.209999999999994 112.826 -173.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 66.9 mtt -79.35 -24.49 42.68 Favored 'General case' 0 N--CA 1.484 1.254 0 N-CA-C 109.854 -0.424 . . . . 73.209999999999994 109.854 172.63 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.441 HG11 ' HA3' ' A' ' 73' ' ' GLY . 60.1 t -98.29 142.27 14.87 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.909 0.883 . . . . 55.119999999999997 108.717 177.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -88.82 142.35 27.74 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 123.864 0.866 . . . . 74.310000000000002 111.556 -175.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.407 ' CD2' ' HE2' ' A' ' 88' ' ' LYS . 52.7 m95 -71.54 -45.37 62.51 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 122.967 0.507 . . . . 71.510000000000005 111.064 172.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -50.44 -32.21 17.22 Favored 'General case' 0 N--CA 1.498 1.963 0 C-N-CA 124.56 1.144 . . . . 74.319999999999993 112.572 -177.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 18.4 m -73.97 -54.32 8.16 Favored 'General case' 0 CA--C 1.556 1.187 0 CA-C-N 115.467 -0.788 . . . . 75.040000000000006 110.839 178.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.521 HG23 ' SG ' ' A' ' 71' ' ' CYS . 10.5 mt -81.33 -22.4 10.54 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 124.318 1.047 . . . . 75.030000000000001 112.376 -170.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -60.69 -50.57 84.7 Favored Pre-proline 0 CA--C 1.557 1.246 0 C-N-CA 124.316 1.046 . . . . 74.409999999999997 113.512 -168.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_endo -62.3 -28.44 78.85 Favored 'Trans proline' 0 C--N 1.385 2.49 0 C-N-CA 121.564 1.509 . . . . 65.329999999999998 111.97 178.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -70.68 -40.31 73.02 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 123.973 0.909 . . . . 71.040000000000006 111.219 179.34 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.419 HG21 HG13 ' A' ' 86' ' ' ILE . 71.4 mt -68.99 -45.9 79.61 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.003 0 N-CA-C 109.811 -0.44 . . . . 73.450000000000003 109.811 178.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.448 HG23 ' HB ' ' A' ' 19' ' ' ILE . 88.4 mt -53.57 -40.63 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 C-N-CA 123.585 0.754 . . . . 54.119999999999997 110.597 175.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -74.37 -37.57 63.41 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.523 -0.762 . . . . 43.0 111.505 -179.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.55 HD22 ' HB3' ' A' ' 66' ' ' GLN . 48.8 mt -64.75 -33.43 75.96 Favored 'General case' 0 N--CA 1.491 1.609 0 C-N-CA 123.662 0.785 . . . . 64.310000000000002 111.6 175.031 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.36 -25.03 62.2 Favored 'General case' 0 C--O 1.218 -0.604 0 CA-C-N 115.716 -0.675 . . . . 74.340000000000003 110.275 173.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 26.0 m -79.85 -33.76 39.91 Favored 'General case' 0 CA--C 1.556 1.21 0 N-CA-C 109.05 -0.722 . . . . 63.509999999999998 109.05 176.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -64.67 -50.57 66.52 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.285 0.634 . . . . 74.420000000000002 111.08 175.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.519 ' HG3' ' HB2' ' A' ' 63' ' ' LEU . 0.0 OUTLIER -68.16 -56.13 9.87 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.98 0.912 . . . . 75.25 110.431 -173.216 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' A' ' 113' ' ' GLU . 66.9 mt -67.76 -11.96 59.54 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.679 0.792 . . . . 62.109999999999999 112.527 -173.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.07 -39.59 93.44 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.263 0.625 . . . . 60.219999999999999 110.386 173.273 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -94.26 -37.7 11.39 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.488 -0.778 . . . . 71.209999999999994 110.516 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -177.55 160.33 26.92 Favored Glycine 0 C--N 1.349 1.295 0 N-CA-C 114.243 0.457 . . . . 41.109999999999999 114.243 178.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.472 ' HA ' HD23 ' A' ' 109' ' ' LEU . 0.2 OUTLIER -86.29 -16.98 35.82 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.429 1.092 . . . . 74.329999999999998 111.604 179.904 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 17.5 m-20 -67.3 107.95 2.57 Favored 'General case' 0 C--O 1.24 0.593 0 C-N-CA 123.345 0.658 . . . . 51.240000000000002 111.262 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.583 HG23 ' HB3' ' A' ' 63' ' ' LEU . 2.9 p -73.71 -34.07 39.98 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.153 0 CA-C-N 115.459 -0.791 . . . . 74.200000000000003 109.91 170.164 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.56 HG12 HG13 ' A' ' 115' ' ' VAL . 22.4 mm -105.52 69.18 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.552 0.741 . . . . 73.219999999999999 110.306 -178.099 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 73.6 m 62.72 157.15 0.06 Allowed 'General case' 0 N--CA 1.499 1.989 0 C-N-CA 125.428 1.491 . . . . 55.5 114.75 173.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -159.23 11.35 0.14 Allowed 'General case' 0 N--CA 1.483 1.19 0 N-CA-C 113.606 0.965 . . . . 72.209999999999994 113.606 -178.883 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 CA--C 1.561 1.369 0 N-CA-C 109.419 -0.585 . . . . 73.140000000000001 109.419 176.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.483 1.182 0 N-CA-C 109.807 -0.442 . . . . 73.439999999999998 109.807 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -116.71 -82.55 0.94 Allowed Glycine 0 C--N 1.342 0.891 0 N-CA-C 111.626 -0.589 . . . . 62.0 111.626 178.599 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 21.1 m80 57.35 23.13 8.55 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 124.49 1.116 . . . . 71.219999999999999 113.156 -178.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 9.7 p-80 -113.44 78.54 1.15 Allowed 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 122.215 1.007 . . . . 53.329999999999998 109.624 174.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 43.1 t60 -125.31 88.09 2.81 Favored 'General case' 0 C--O 1.24 0.558 0 N-CA-C 107.539 -1.282 . . . . 64.439999999999998 107.539 177.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 85.3 m-70 -106.36 112.11 24.98 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-N 115.71 -0.677 . . . . 72.099999999999994 110.847 -170.265 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.8 m-70 -131.15 118.85 21.07 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.361 1.064 . . . . 53.439999999999998 108.349 171.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.1 t-80 -130.9 58.99 1.68 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 107.801 -1.185 . . . . 51.229999999999997 107.801 177.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 46.7 m -121.84 92.75 3.8 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 114.909 -1.041 . . . . 60.439999999999998 109.568 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 69.3 m-70 -133.2 84.5 2.14 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 108.203 -1.036 . . . . 60.140000000000001 108.203 178.168 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 94.4 mmm -73.21 82.67 1.34 Allowed 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 109.36 -0.608 . . . . 74.319999999999993 109.36 176.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.6 p30 -98.77 105.95 18.15 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.69 -0.686 . . . . 73.299999999999997 109.297 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 61.5 p -168.02 125.83 1.16 Allowed 'General case' 0 C--O 1.238 0.478 0 C-N-CA 124.0 0.92 . . . . 65.109999999999999 109.202 -178.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 32.7 tt0 -160.66 115.08 2.15 Favored 'General case' 0 N--CA 1.467 0.416 0 C-N-CA 123.714 0.806 . . . . 75.030000000000001 109.019 175.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.69 167.53 12.45 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.967 0.907 . . . . 72.200000000000003 109.731 -176.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -137.1 139.94 41.6 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 108.007 -1.108 . . . . 74.519999999999996 108.007 168.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.58 HG21 ' HB2' ' A' ' 109' ' ' LEU . 1.6 mp -73.67 93.09 0.65 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.615 0 N-CA-C 107.328 -1.36 . . . . 64.120000000000005 107.328 176.617 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 45.0 t-80 -67.65 131.73 46.15 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.284 -0.871 . . . . 73.319999999999993 109.224 178.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.559 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.7 mm -112.78 124.9 69.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 N-CA-C 105.975 -1.861 . . . . 61.210000000000001 105.975 -178.93 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.453 ' HD3' HD23 ' A' ' 33' ' ' LEU . 51.3 tttp -90.75 159.7 16.19 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 107.318 -1.364 . . . . 71.25 107.318 -179.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.499 HG21 ' HE3' ' A' ' 98' ' ' LYS . 41.2 m -137.83 133.17 33.63 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.893 -0.78 . . . . 75.519999999999996 108.893 176.882 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.541 HD11 HD22 ' A' ' 33' ' ' LEU . 50.6 mt -117.48 139.23 51.2 Favored 'General case' 0 C--O 1.243 0.736 0 N-CA-C 107.474 -1.306 . . . . 51.439999999999998 107.474 177.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 62.5 p -69.98 155.79 40.06 Favored 'General case' 0 C--O 1.243 0.751 0 C-N-CA 122.64 0.376 . . . . 61.329999999999998 110.296 175.271 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 13.0 p -131.35 149.53 73.86 Favored Pre-proline 0 CA--C 1.548 0.867 0 C-N-CA 124.31 1.044 . . . . 61.32 108.94 -177.337 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -70.3 -9.61 26.31 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 122.538 2.158 . . . . 55.32 113.308 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.435 HD22 ' N ' ' A' ' 29' ' ' ALA . 7.9 t30 -101.02 128.33 47.1 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.42 0.688 . . . . 71.150000000000006 109.446 174.824 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -68.0 -35.87 79.04 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.544 1.137 . . . . 73.019999999999996 113.315 -175.679 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -78.43 -16.01 58.04 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 122.993 0.517 . . . . 62.240000000000002 111.111 179.544 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.437 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -102.23 151.44 22.21 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.823 0.849 . . . . 51.109999999999999 110.155 -178.189 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 58.9 tp -160.74 118.82 2.49 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 108.112 -1.07 . . . . 72.329999999999998 108.112 172.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 19.2 ptmt -90.69 130.91 36.64 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-O 121.489 0.662 . . . . 53.530000000000001 110.531 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -104.13 119.62 39.35 Favored 'General case' 0 N--CA 1.464 0.245 0 N-CA-C 107.249 -1.389 . . . . 74.519999999999996 107.249 174.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.541 HD22 HD11 ' A' ' 22' ' ' LEU . 23.6 tp -98.54 123.47 42.73 Favored 'General case' 0 CA--C 1.538 0.49 0 N-CA-C 108.517 -0.92 . . . . 73.019999999999996 108.517 -172.228 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 48.4 m -90.53 105.78 18.05 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 108.47 -0.937 . . . . 73.450000000000003 108.47 178.605 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 12.5 t -136.83 8.06 3.0 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-N 115.745 -0.661 . . . . 70.530000000000001 111.416 -174.199 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -145.63 141.25 27.98 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 108.146 -1.057 . . . . 74.319999999999993 108.146 175.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.564 ' HA3' HG13 ' A' ' 17' ' ' ILE . . . 81.91 -90.05 1.45 Allowed Glycine 0 C--N 1.34 0.79 0 N-CA-C 110.816 -0.914 . . . . 65.540000000000006 110.816 -173.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -134.26 -179.59 5.66 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.128 0.971 . . . . 63.310000000000002 109.958 178.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 12.3 ptp -111.88 162.14 15.62 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 124.128 0.971 . . . . 70.340000000000003 108.422 161.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.418 ' CD1' ' HB2' ' A' ' 84' ' ' LEU . 74.4 mt -70.66 -38.71 73.83 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.783 0.833 . . . . 64.409999999999997 111.731 -175.05 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.728 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.6 tt0 -148.48 140.84 24.23 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 107.735 -1.209 . . . . 75.319999999999993 107.735 -178.161 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 28.3 m -60.22 107.69 0.68 Allowed 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.617 0.767 . . . . 52.340000000000003 110.65 -176.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.499 ' HA ' ' HB3' ' A' ' 81' ' ' ASP . 11.9 ttp180 -55.58 107.58 0.35 Allowed 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.892 0.877 . . . . 65.540000000000006 112.388 -167.467 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 165.01 -8.38 0.07 OUTLIER Glycine 0 C--N 1.338 0.673 0 CA-C-N 114.56 -1.2 . . . . 74.340000000000003 113.194 -177.344 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 15.6 t -103.44 -168.57 1.52 Allowed 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 123.679 0.792 . . . . 73.230000000000004 110.064 176.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -94.4 178.61 5.56 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 124.597 1.159 . . . . 72.109999999999999 111.513 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 55.2 m -91.79 128.91 37.8 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.892 0.877 . . . . 53.450000000000003 109.818 173.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 3.8 mp -96.74 119.52 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.039 0 C-N-CA 124.197 0.999 . . . . 75.239999999999995 109.016 -178.69 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 58.8 t -91.49 110.33 22.37 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 CA-C-N 118.447 0.567 . . . . 73.319999999999993 109.786 -179.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.518 HD11 HD11 ' A' ' 116' ' ' ILE . 67.1 mt -101.95 109.74 26.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.46 1.104 . . . . 74.230000000000004 108.81 176.164 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 87.7 mttt -93.12 151.05 20.09 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.214 0.606 . . . . 73.5 109.882 -179.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.469 ' HA ' HD11 ' A' ' 58' ' ' ILE . 47.3 p30 -66.95 -24.32 66.06 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.387 0.675 . . . . 73.540000000000006 112.137 179.297 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.8 t -84.52 -7.07 59.39 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.975 0.91 . . . . 60.020000000000003 112.008 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -111.66 88.7 2.86 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.272 0.629 . . . . 73.239999999999995 109.795 178.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.44 -35.26 51.85 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.273 1.029 . . . . 75.209999999999994 111.653 179.283 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -57.3 -53.39 58.71 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 124.511 1.124 . . . . 74.239999999999995 111.094 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 91.5 mt -64.8 -34.41 78.28 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 115.417 -0.81 . . . . 71.200000000000003 111.231 -176.721 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.517 HG22 ' HG2' ' A' ' 65' ' ' GLN . 66.6 mt -70.09 -47.33 68.74 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 124.188 0.995 . . . . 74.030000000000001 110.217 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -62.29 -19.33 63.15 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 124.473 1.109 . . . . 53.43 112.683 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 59.1 t-80 -69.25 -54.86 12.56 Favored 'General case' 0 C--N 1.351 0.648 0 CA-C-O 121.334 0.587 . . . . 74.329999999999998 109.732 172.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 16.3 m -94.67 107.82 19.81 Favored 'General case' 0 CA--C 1.534 0.342 0 CA-C-N 115.103 -0.953 . . . . 72.219999999999999 110.478 -172.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.438 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 38.7 ttpt -59.1 -33.27 70.63 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.018 0.527 . . . . 73.239999999999995 109.741 174.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.417 HD11 HD12 ' A' ' 105' ' ' LEU . 30.6 tp -59.23 -46.52 88.25 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.619 1.167 . . . . 71.219999999999999 110.637 177.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.09 -47.02 84.49 Favored 'General case' 0 C--N 1.355 0.83 0 C-N-CA 123.85 0.86 . . . . 55.439999999999998 110.658 178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.517 ' HG2' HG22 ' A' ' 58' ' ' ILE . 65.9 mt-30 -59.1 -39.94 83.77 Favored 'General case' 0 N--CA 1.474 0.728 0 O-C-N 124.58 1.175 . . . . 74.209999999999994 110.967 -178.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.547 ' O ' ' HG2' ' A' ' 70' ' ' GLN . 17.0 mm100 -66.73 -45.77 77.59 Favored 'General case' 0 C--O 1.214 -0.806 0 CA-C-O 118.513 -0.756 . . . . 63.130000000000003 110.891 176.107 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -58.33 -43.61 86.6 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 CA-C-N 118.63 0.65 . . . . 63.130000000000003 110.68 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -68.58 -32.79 72.95 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.387 0.675 . . . . 74.409999999999997 111.342 175.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 30.6 tp -68.16 -34.8 76.99 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 123.439 0.696 . . . . 74.200000000000003 110.817 175.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.547 ' HG2' ' O ' ' A' ' 66' ' ' GLN . 7.1 mm100 -75.16 -41.31 58.4 Favored 'General case' 0 N--CA 1.474 0.749 0 CA-C-O 120.983 0.421 . . . . 75.340000000000003 110.007 -178.77 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.446 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 61.0 m -151.43 100.57 2.97 Favored Pre-proline 0 CA--C 1.552 1.026 0 C-N-CA 124.136 0.974 . . . . 53.340000000000003 108.503 -176.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_exo -67.25 1.95 2.61 Favored 'Trans proline' 0 C--N 1.376 2.023 0 C-N-CA 123.381 2.721 . . . . 74.129999999999995 114.349 175.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -80.58 -5.42 89.92 Favored Glycine 0 C--N 1.352 1.457 0 CA-C-O 119.749 -0.473 . . . . 71.450000000000003 113.544 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 59.1 t -74.09 127.04 35.69 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.935 0 C-N-CA 123.063 0.545 . . . . 74.450000000000003 110.243 177.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 -84.79 -45.5 12.3 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 123.934 0.894 . . . . 54.32 110.874 -177.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.9 p -156.92 166.2 34.02 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-O 121.789 0.804 . . . . 71.040000000000006 110.923 179.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 58.1 mt -126.18 127.62 45.98 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 107.157 -1.423 . . . . 74.129999999999995 107.157 178.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.615 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 53.3 ttm -103.56 96.75 6.94 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 106.989 -1.485 . . . . 71.010000000000005 106.989 173.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 29.4 mm -77.88 101.01 3.36 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-N 114.893 -1.049 . . . . 51.399999999999999 108.685 -175.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.88 174.24 44.07 Favored Glycine 0 C--O 1.247 0.967 0 N-CA-C 110.31 -1.116 . . . . 64.140000000000001 110.31 176.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.728 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 2.5 m-20 -76.64 -56.67 4.4 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 121.791 0.805 . . . . 55.219999999999999 109.808 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.8 t70 -101.9 -7.79 22.15 Favored 'General case' 0 CA--C 1.545 0.782 0 CA-C-N 114.474 -1.239 . . . . 65.129999999999995 111.114 -174.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.7 p90 -139.9 172.32 12.94 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.452 0.701 . . . . 74.549999999999997 110.654 -176.313 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.418 ' HB2' ' CD1' ' A' ' 40' ' ' LEU . 35.7 tp -143.75 106.93 4.52 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.872 0.469 . . . . 75.219999999999999 110.13 177.376 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.615 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 61.0 m -95.8 103.49 15.38 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 108.851 -0.796 . . . . 65.129999999999995 108.851 -176.346 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.632 HG13 HD13 ' A' ' 101' ' ' ILE . 15.7 mm -87.88 122.55 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 N-CA-C 108.554 -0.906 . . . . 72.010000000000005 108.554 -177.101 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 30.1 m-80 -108.35 113.57 26.75 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 108.153 -1.054 . . . . 74.129999999999995 108.153 179.486 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -122.74 177.55 5.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.45 0.7 . . . . 74.430000000000007 110.446 -175.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -77.16 136.85 38.61 Favored 'General case' 0 N--CA 1.474 0.759 0 C-N-CA 123.184 0.593 . . . . 75.030000000000001 110.109 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -67.74 -22.18 65.24 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 112.86 0.689 . . . . 70.439999999999998 112.86 -171.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 71.8 mtm -79.81 -22.89 42.51 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 122.866 0.466 . . . . 54.149999999999999 110.888 176.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 38.5 t -89.56 141.72 13.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 N-CA-C 108.028 -1.101 . . . . 73.540000000000006 108.028 176.681 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 68.7 m80 -110.9 157.24 20.09 Favored 'General case' 0 N--CA 1.487 1.402 0 N-CA-C 112.612 0.597 . . . . 74.319999999999993 112.612 -171.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 92.5 m95 -70.74 -25.22 62.83 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.19 0.996 . . . . 71.239999999999995 112.93 -176.423 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.3 p-10 -59.2 -24.87 63.48 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 120.977 0.417 . . . . 71.519999999999996 111.043 -177.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 17.8 m -88.87 -42.29 11.94 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.283 1.033 . . . . 74.349999999999994 111.739 177.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.517 HG22 HD11 ' A' ' 101' ' ' ILE . 7.6 mt -91.33 -50.02 12.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.307 0 C-N-CA 122.905 0.482 . . . . 72.340000000000003 111.039 -165.602 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.499 ' HE3' HG21 ' A' ' 21' ' ' THR . 85.8 tttt -50.95 -51.36 67.96 Favored Pre-proline 0 CA--C 1.566 1.561 0 N-CA-C 114.509 1.3 . . . . 74.310000000000002 114.509 -174.526 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 20.7 Cg_endo -57.26 -35.15 98.85 Favored 'Trans proline' 0 C--N 1.398 3.143 0 C-N-CA 121.884 1.723 . . . . 73.519999999999996 112.147 -179.42 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.427 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 26.0 mm-40 -67.53 -46.02 74.01 Favored 'General case' 0 C--O 1.221 -0.429 0 CA-C-N 115.159 -0.928 . . . . 73.239999999999995 110.268 179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.632 HD13 HG13 ' A' ' 86' ' ' ILE . 76.7 mt -61.53 -47.11 94.9 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.611 0.764 . . . . 50.350000000000001 110.565 -178.675 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.559 HG23 ' HB ' ' A' ' 19' ' ' ILE . 76.8 mt -57.86 -45.55 87.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 O-C-N 123.659 0.599 . . . . 74.409999999999997 110.25 178.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -59.37 -48.0 83.3 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.851 0.86 . . . . 74.299999999999997 111.273 178.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 95.7 mt -62.88 -40.0 96.18 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.033 0.933 . . . . 73.310000000000002 111.726 -178.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.417 HD12 HD11 ' A' ' 63' ' ' LEU . 9.4 mp -71.74 -27.9 63.31 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.758 0.823 . . . . 70.400000000000006 110.933 178.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 97.5 m -74.25 -47.01 37.89 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.922 0.489 . . . . 74.340000000000003 109.775 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -76.15 -34.6 59.4 Favored 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 115.399 -0.819 . . . . 73.319999999999993 111.357 -174.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.665 ' HG3' ' HB2' ' A' ' 113' ' ' GLU . 30.8 tt0 -59.31 -55.34 36.09 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.92 0.488 . . . . 63.149999999999999 109.997 175.877 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.58 ' HB2' HG21 ' A' ' 17' ' ' ILE . 80.9 mt -73.43 -16.95 61.3 Favored 'General case' 0 CA--C 1.547 0.862 0 CA-C-N 115.299 -0.864 . . . . 65.319999999999993 111.119 -175.266 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -68.35 -46.3 70.51 Favored 'General case' 0 N--CA 1.48 1.066 0 C-N-CA 123.347 0.659 . . . . 72.040000000000006 110.407 171.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.499 ' HB2' ' HG3' ' A' ' 113' ' ' GLU . 18.8 m-85 -73.79 -19.22 60.83 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 115.963 -0.562 . . . . 73.019999999999996 110.155 173.678 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.57 44.4 26.7 Favored Glycine 0 C--N 1.35 1.358 0 N-CA-C 111.584 -0.607 . . . . 74.340000000000003 111.584 -179.084 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.665 ' HB2' ' HG3' ' A' ' 108' ' ' GLN . 44.0 mt-10 -88.69 174.9 7.76 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.747 0.819 . . . . 55.32 111.25 -177.667 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -109.85 128.21 55.19 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 124.685 1.194 . . . . 73.409999999999997 108.928 -178.321 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 5.1 p -75.93 -53.69 15.16 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.802 0 N-CA-C 107.591 -1.262 . . . . 71.239999999999995 107.591 165.378 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.518 HD11 HD11 ' A' ' 50' ' ' ILE . 30.7 mm -125.37 120.76 58.82 Favored 'Isoleucine or valine' 0 C--N 1.346 0.45 0 N-CA-C 106.207 -1.775 . . . . 61.350000000000001 106.207 167.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 37.4 t -80.65 -177.86 6.48 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.033 0.933 . . . . 60.149999999999999 111.04 -175.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -83.7 15.49 3.18 Favored 'General case' 0 CA--C 1.557 1.237 0 C-N-CA 124.766 1.226 . . . . 55.310000000000002 111.245 171.612 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 . . . . . 0 CA--C 1.556 1.176 0 C-N-CA 124.321 1.049 . . . . 74.040000000000006 109.842 177.803 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.478 0.959 0 N-CA-C 109.12 -0.696 . . . . 72.349999999999994 109.12 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 136.59 121.98 2.11 Favored Glycine 0 C--N 1.349 1.261 0 O-C-N 123.514 0.509 . . . . 72.239999999999995 112.223 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 11.9 p80 -158.56 103.16 1.74 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.649 0.78 . . . . 73.239999999999995 109.943 175.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 26.0 t60 -144.17 93.65 2.47 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 108.742 -0.836 . . . . 64.129999999999995 108.742 -179.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 31.8 m-70 -122.93 108.68 13.22 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.78 0.832 . . . . 72.430000000000007 109.248 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 55.8 m-70 -136.08 62.87 1.61 Allowed 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.953 0.901 . . . . 65.409999999999997 109.3 -179.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 3.7 t60 -95.45 135.67 36.8 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.197 -0.911 . . . . 71.010000000000005 109.501 -178.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -128.93 137.21 51.27 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.399 0.679 . . . . 71.329999999999998 109.831 -178.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 14.4 t -167.09 123.45 1.16 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.958 0.503 . . . . 71.329999999999998 110.191 -179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 16.5 p80 -156.78 136.71 12.58 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.667 0.787 . . . . 72.540000000000006 109.73 174.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.0 ttp -153.55 98.26 2.21 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 108.598 -0.889 . . . . 74.319999999999993 108.598 177.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -151.22 117.26 5.56 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.277 0.631 . . . . 44.530000000000001 109.421 -175.029 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 45.1 m -139.44 92.94 2.62 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.46 0.704 . . . . 73.329999999999998 109.598 179.065 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 83.5 mm-40 -88.94 119.86 29.84 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.564 0.745 . . . . 63.109999999999999 109.972 175.207 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.514 ' NE ' ' HA ' ' A' ' 15' ' ' ARG . 2.2 mmp_? -103.56 119.81 39.62 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 123.804 0.841 . . . . 71.540000000000006 109.175 173.341 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.538 HD23 ' H ' ' A' ' 16' ' ' LEU . 2.3 pt? -121.82 126.2 48.23 Favored 'General case' 0 C--O 1.243 0.712 0 N-CA-C 107.646 -1.242 . . . . 74.5 107.646 177.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.415 ' O ' HG12 ' A' ' 19' ' ' ILE . 67.6 mt -73.05 135.14 28.34 Favored 'Isoleucine or valine' 0 C--O 1.238 0.468 0 N-CA-C 107.357 -1.349 . . . . 74.510000000000005 107.357 172.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 72.3 m80 -67.51 105.42 1.83 Allowed 'General case' 0 C--O 1.241 0.644 0 CA-C-O 121.494 0.664 . . . . 75.319999999999993 110.25 -171.613 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.415 HG12 ' O ' ' A' ' 17' ' ' ILE . 49.8 mm -118.79 109.95 28.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 N-CA-C 106.378 -1.712 . . . . 74.200000000000003 106.378 -176.826 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -92.87 119.48 32.23 Favored 'General case' 0 C--O 1.237 0.422 0 N-CA-C 108.678 -0.86 . . . . 74.510000000000005 108.678 -174.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 9.9 t -92.55 118.79 31.37 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 108.734 -0.839 . . . . 62.219999999999999 108.734 -178.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.4 mt -124.58 140.7 52.7 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 124.331 1.052 . . . . 71.329999999999998 109.19 -173.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 17.9 p -82.09 152.96 26.33 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 122.77 0.428 . . . . 70.400000000000006 110.595 178.018 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.7 p -114.4 169.94 6.01 Favored Pre-proline 0 CA--C 1.553 1.06 0 C-N-CA 124.119 0.968 . . . . 63.130000000000003 108.645 -178.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 41.4 Cg_exo -59.63 -12.22 16.92 Favored 'Trans proline' 0 C--N 1.381 2.252 0 C-N-CA 122.487 2.124 . . . . 62.210000000000001 113.598 168.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.494 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 84.0 m-20 -95.0 151.49 19.12 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.203 1.001 . . . . 64.409999999999997 110.701 176.54 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -82.86 -45.26 14.46 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.265 0.626 . . . . 71.129999999999995 109.966 174.368 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.8 m120 -92.52 29.95 1.62 Allowed 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.067 0.947 . . . . 64.219999999999999 111.048 -174.808 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.494 ' HB3' ' HB2' ' A' ' 26' ' ' ASN . . . -139.45 127.6 22.49 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 123.9 0.88 . . . . 74.530000000000001 108.769 171.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 45.9 tp -129.1 125.64 37.61 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.869 -1.159 . . . . 70.329999999999998 107.869 174.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -82.62 133.05 35.18 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.094 0.958 . . . . 73.510000000000005 110.588 -177.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 91.0 m-85 -117.01 122.96 45.71 Favored 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 107.885 -1.154 . . . . 73.209999999999994 107.885 171.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.7 tp -118.31 130.56 56.1 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.422 0.689 . . . . 73.0 111.099 -169.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 14.5 p -90.11 120.95 31.73 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 108.538 -0.912 . . . . 73.239999999999995 108.538 175.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 60.0 p -108.9 -26.95 9.97 Favored 'General case' 0 N--CA 1.483 1.191 0 N-CA-C 113.669 0.988 . . . . 75.209999999999994 113.669 -164.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -72.32 -37.65 68.86 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-N 118.113 0.415 . . . . 74.409999999999997 110.599 -175.045 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 157.18 1.24 0.1 OUTLIER Glycine 0 C--N 1.345 1.037 0 CA-C-O 119.514 -0.604 . . . . 34.32 114.218 175.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.524 ' HB3' HD22 ' A' ' 109' ' ' LEU . 18.6 mp0 -79.77 84.84 5.51 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.365 0.666 . . . . 74.299999999999997 110.879 -171.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 79.7 mtp -77.72 124.81 28.43 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.118 0.485 . . . . 75.010000000000005 110.457 -179.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.585 ' HB3' HG12 ' A' ' 115' ' ' VAL . 95.6 mt -65.64 -33.23 75.41 Favored 'General case' 0 C--O 1.243 0.762 0 C-N-CA 125.142 1.377 . . . . 71.109999999999999 112.209 -177.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.576 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 29.1 tt0 -147.73 153.75 39.67 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.81 1.244 . . . . 74.109999999999999 107.76 -174.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 5.0 t -75.78 129.09 36.49 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 122.246 0.218 . . . . 72.319999999999993 110.55 -174.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 4.0 tpm_? -51.29 97.83 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.439 1.495 . . . . 75.239999999999995 110.988 179.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 143.61 -20.77 2.2 Favored Glycine 0 C--N 1.342 0.894 0 CA-C-N 116.066 -0.515 . . . . 72.530000000000001 112.286 -178.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 63.8 m -85.91 125.7 33.53 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 123.412 0.685 . . . . 54.409999999999997 109.157 174.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 24.2 pttm -62.12 145.88 52.08 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 123.014 0.526 . . . . 74.329999999999998 111.665 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 50.1 m -63.05 113.09 2.91 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.107 0.963 . . . . 73.209999999999994 111.441 -174.248 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 62.6 mt -80.85 116.1 24.55 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.648 0 C-N-CA 123.607 0.763 . . . . 70.219999999999999 110.365 -174.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 64.4 t -91.55 108.26 19.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 N-CA-C 109.082 -0.71 . . . . 64.439999999999998 109.082 -179.241 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.416 ' HB ' ' HB2' ' A' ' 77' ' ' LEU . 73.3 mt -96.45 110.28 24.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.654 0 N-CA-C 108.066 -1.087 . . . . 63.43 108.066 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 10.4 mtmp? -92.52 161.66 14.53 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.869 0.467 . . . . 74.049999999999997 110.279 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 29.9 p30 -65.58 -25.82 67.57 Favored 'General case' 0 N--CA 1.485 1.32 0 N-CA-C 113.736 1.013 . . . . 74.109999999999999 113.736 -175.059 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 73.0 p -84.9 -12.1 54.15 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.384 0.274 . . . . 62.039999999999999 111.462 176.193 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 54.9 m-20 -82.89 68.97 9.59 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.32 0.648 . . . . 73.450000000000003 110.043 -177.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -49.26 -39.33 30.09 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.504 1.522 . . . . 71.219999999999999 111.648 176.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 39.6 t-20 -60.23 -50.13 74.89 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 124.568 1.147 . . . . 63.149999999999999 110.568 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 71.2 mt -74.73 -28.93 60.99 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.855 0.462 . . . . 55.100000000000001 111.559 -174.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 82.8 mt -67.14 -49.2 75.19 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 N-CA-C 109.224 -0.658 . . . . 61.109999999999999 109.224 174.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 56.3 m-80 -66.54 -24.42 66.37 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 112.121 0.415 . . . . 63.520000000000003 112.121 177.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 14.9 m80 -79.77 -24.74 41.31 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 112.022 0.379 . . . . 60.520000000000003 112.022 175.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 36.9 t -114.97 108.52 16.81 Favored 'General case' 0 N--CA 1.483 1.192 0 N-CA-C 109.747 -0.464 . . . . 73.430000000000007 109.747 177.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -64.54 -31.64 72.94 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.057 0.543 . . . . 63.149999999999999 110.778 -179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.524 ' HB2' ' NE2' ' A' ' 108' ' ' GLN . 58.6 tp -60.74 -41.63 95.77 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.517 0.727 . . . . 72.129999999999995 110.599 173.578 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -57.65 -47.39 82.4 Favored 'General case' 0 C--N 1.355 0.829 0 C-N-CA 122.837 0.455 . . . . 42.520000000000003 110.459 177.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -59.17 -44.77 92.16 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-N 115.077 -0.965 . . . . 70.230000000000004 110.571 179.828 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.1 mm-40 -59.75 -53.33 59.22 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.811 0.844 . . . . 71.120000000000005 112.488 177.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.689 HG22 HG21 ' A' ' 74' ' ' VAL . 59.6 mt -65.51 -39.82 86.27 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.381 0 C-N-CA 123.084 0.554 . . . . 63.25 111.143 -174.645 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -66.78 -31.03 71.4 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 123.337 0.655 . . . . 74.140000000000001 111.51 174.367 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 65.3 tp -70.85 -52.78 18.22 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.872 0.469 . . . . 72.349999999999994 110.744 178.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 9.4 mm-40 -69.79 -29.23 66.49 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.321 -0.854 . . . . 74.209999999999994 110.894 -174.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.628 ' SG ' HG23 ' A' ' 97' ' ' ILE . 82.3 m -144.61 96.33 5.2 Favored Pre-proline 0 CA--C 1.546 0.823 0 N-CA-C 108.884 -0.784 . . . . 54.25 108.884 176.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_exo -63.87 -4.57 7.54 Favored 'Trans proline' 0 N--CA 1.5 1.911 0 C-N-CA 123.276 2.651 . . . . 73.239999999999995 114.315 175.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.523 ' HA3' HG21 ' A' ' 92' ' ' VAL . . . -86.99 8.64 75.56 Favored Glycine 0 C--N 1.348 1.243 0 CA-C-O 119.555 -0.581 . . . . 70.230000000000004 113.794 -179.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.689 HG21 HG22 ' A' ' 67' ' ' ILE . 99.9 t -69.79 124.74 26.41 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.739 0 C-N-CA 123.192 0.597 . . . . 64.310000000000002 110.073 173.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -86.05 -56.6 3.39 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.905 -0.776 . . . . 72.5 108.905 -179.086 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 61.1 m -147.74 167.92 23.43 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 115.768 -0.651 . . . . 61.32 110.891 -178.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.416 ' HB2' ' HB ' ' A' ' 50' ' ' ILE . 77.3 mt -127.16 148.54 50.17 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.535 1.134 . . . . 71.549999999999997 109.097 176.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.539 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.0 ttm -126.17 111.02 14.13 Favored 'General case' 0 C--O 1.239 0.512 0 N-CA-C 108.051 -1.092 . . . . 54.549999999999997 108.051 169.094 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 40.0 mm -89.35 103.01 13.64 Favored 'Isoleucine or valine' 0 C--O 1.234 0.251 0 N-CA-C 108.37 -0.974 . . . . 71.439999999999998 108.37 -179.354 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.9 176.81 41.22 Favored Glycine 0 C--O 1.243 0.671 0 N-CA-C 111.5 -0.64 . . . . 75.140000000000001 111.5 177.527 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.576 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 3.9 m-20 -69.96 -60.28 2.4 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-O 121.737 0.779 . . . . 61.409999999999997 109.611 179.549 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -105.23 -17.28 14.52 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.82 -1.082 . . . . 72.040000000000006 110.302 -177.648 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 27.3 p90 -118.63 167.99 11.12 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.363 0.665 . . . . 73.030000000000001 111.556 -171.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 31.8 tp -141.3 142.59 33.85 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.512 0.725 . . . . 75.439999999999998 109.326 175.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.539 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 86.8 m -131.03 118.15 20.17 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.289 0.636 . . . . 64.120000000000005 109.685 174.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 19.7 mm -108.77 108.17 24.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 109.922 -0.399 . . . . 63.25 109.922 -177.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 32.4 m-80 -83.15 146.62 28.54 Favored 'General case' 0 N--CA 1.478 0.975 0 C-N-CA 123.382 0.673 . . . . 71.209999999999994 110.53 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.776 ' HE2' HG21 ' A' ' 97' ' ' ILE . 34.6 mmtm -123.51 171.59 9.39 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.893 0.877 . . . . 72.010000000000005 110.322 173.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 10.1 t70 -78.65 149.13 32.94 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 107.891 -1.151 . . . . 62.43 107.891 163.301 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 2.7 ptm180 -62.79 -24.44 67.74 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.432 0.693 . . . . 73.230000000000004 112.599 -175.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 21.5 ptm -73.13 -18.79 61.25 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.059 0.544 . . . . 50.399999999999999 111.822 -177.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.523 HG21 ' HA3' ' A' ' 73' ' ' GLY . 8.5 t -100.98 137.14 29.52 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 123.64 0.776 . . . . 63.200000000000003 109.811 -175.085 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 43.4 m80 -97.76 148.52 23.28 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.541 0.736 . . . . 73.140000000000001 111.733 -174.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 99.4 m95 -74.41 -36.43 63.47 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.941 1.296 . . . . 75.530000000000001 113.306 -173.693 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -52.57 -29.04 23.58 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 124.333 1.053 . . . . 60.5 113.241 -173.325 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 32.7 p -83.07 -36.51 24.84 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.399 0.68 . . . . 74.329999999999998 110.676 -178.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.776 HG21 ' HE2' ' A' ' 88' ' ' LYS . 48.2 mt -89.6 -29.53 5.09 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.731 0 CA-C-N 115.118 -0.946 . . . . 72.140000000000001 112.196 -164.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -53.3 -53.43 56.23 Favored Pre-proline 0 CA--C 1.562 1.426 0 CA-C-O 117.766 -1.111 . . . . 72.420000000000002 112.546 -176.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_endo -59.87 -31.94 94.56 Favored 'Trans proline' 0 C--N 1.395 3.015 0 C-N-CA 121.927 1.752 . . . . 72.450000000000003 112.51 178.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -64.01 -52.75 58.06 Favored 'General case' 0 N--CA 1.472 0.646 0 O-C-N 123.37 0.419 . . . . 71.439999999999998 111.272 177.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 67.5 mt -66.58 -43.7 90.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 122.989 0.515 . . . . 73.450000000000003 110.828 -176.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 93.5 mt -58.54 -40.41 78.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 122.89 0.476 . . . . 64.319999999999993 110.49 178.266 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 24.8 t70 -66.17 -46.99 75.45 Favored 'General case' 0 N--CA 1.481 1.095 0 O-C-N 123.326 0.391 . . . . 71.430000000000007 111.046 178.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.1 mt -62.31 -34.88 77.46 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 123.526 0.73 . . . . 73.420000000000002 111.469 -179.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 8.6 mp -71.66 -35.43 70.35 Favored 'General case' 0 N--CA 1.472 0.664 0 C-N-CA 123.46 0.704 . . . . 72.219999999999999 110.555 175.622 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 17' ' ' ILE . 92.3 m -72.9 -32.75 65.57 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 109.638 -0.504 . . . . 64.519999999999996 109.638 179.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm -66.7 -57.2 7.62 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.573 0.749 . . . . 72.200000000000003 110.129 174.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.524 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 26.2 tt0 -53.28 -55.58 23.5 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.062 0.945 . . . . 75.420000000000002 111.637 -176.49 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.524 HD22 ' HB3' ' A' ' 38' ' ' GLU . 76.8 mt -68.87 -15.85 63.61 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 124.162 0.914 . . . . 63.350000000000001 111.609 -174.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -80.34 -20.44 44.19 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.292 0.637 . . . . 50.240000000000002 111.628 175.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 38.9 m-85 -100.93 -28.19 12.89 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.217 0.607 . . . . 74.019999999999996 110.664 175.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.14 140.96 3.66 Favored Glycine 0 C--N 1.344 0.994 0 CA-C-N 115.898 -0.592 . . . . 65.439999999999998 111.805 -179.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -59.69 -33.83 72.1 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 123.898 0.879 . . . . 74.530000000000001 111.857 -177.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 6.9 p-10 -75.77 133.52 40.68 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-O 121.344 0.592 . . . . 74.540000000000006 111.822 -173.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.585 HG12 ' HB3' ' A' ' 40' ' ' LEU . 3.1 p -87.0 -44.53 16.26 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 N-CA-C 107.889 -1.152 . . . . 62.520000000000003 107.889 158.078 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 66.3 mt -134.23 120.26 33.66 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 C-N-CA 124.914 1.286 . . . . 42.109999999999999 107.691 179.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 54.8 m -83.04 69.15 9.78 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 108.465 -0.939 . . . . 62.140000000000001 108.465 173.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -84.04 93.28 8.06 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 115.302 -0.863 . . . . 74.549999999999997 110.262 -177.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 . . . . . 0 C--O 1.25 1.101 0 N-CA-C 106.545 -1.65 . . . . 63.200000000000003 106.545 173.583 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.489 1.494 0 CA-C-O 120.522 0.201 . . . . 72.530000000000001 110.575 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 150.95 39.04 0.03 OUTLIER Glycine 0 C--N 1.347 1.142 0 N-CA-C 112.148 -0.381 . . . . 63.450000000000003 112.148 178.806 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 54.2 m-70 -94.3 63.7 3.09 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.81 0.814 . . . . 65.329999999999998 109.357 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 5.1 p80 -85.32 105.3 15.88 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-N 114.878 -1.055 . . . . 43.140000000000001 111.113 -173.492 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.2 p-80 -154.71 112.89 3.5 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.227 0.611 . . . . 53.509999999999998 110.372 179.148 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -162.13 108.93 1.32 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.169 0.988 . . . . 74.540000000000006 109.032 174.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 12.4 p80 -163.75 73.77 0.3 Allowed 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.348 0.659 . . . . 72.140000000000001 111.078 -177.384 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.7 p-80 -163.68 20.31 0.07 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 123.193 0.597 . . . . 75.450000000000003 112.423 176.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 73.2 p -90.34 113.39 25.25 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 122.706 0.403 . . . . 74.400000000000006 110.202 176.171 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.7 m-70 -119.61 141.62 49.14 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.705 0.802 . . . . 63.109999999999999 109.716 -178.456 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.1 ptt? -140.67 103.78 4.59 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.312 0.577 . . . . 63.210000000000001 110.716 -176.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 5.3 m-20 -126.25 116.52 21.4 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 124.12 0.968 . . . . 65.120000000000005 108.963 179.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 26.6 t -137.51 92.27 2.68 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 109.094 -0.706 . . . . 44.030000000000001 109.094 177.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 12.9 pt20 -90.54 156.37 18.21 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.593 0.757 . . . . 71.299999999999997 110.072 177.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.439 HH22 ' HB2' ' A' ' 36' ' ' ASP . 2.4 ptm180 -139.2 168.26 20.22 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.59 0.756 . . . . 55.32 110.54 177.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 86.4 mt -122.87 175.65 6.43 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.541 0.737 . . . . 74.209999999999994 110.118 170.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.532 ' HB ' HG23 ' A' ' 106' ' ' THR . 93.0 mt -123.18 105.04 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.882 0 C-N-CA 124.097 0.959 . . . . 64.310000000000002 109.745 -176.324 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 83.7 m-70 -84.67 135.46 34.15 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.1 0.56 . . . . 63.200000000000003 110.028 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.54 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.7 mm -128.78 122.23 56.53 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 107.522 -1.288 . . . . 60.409999999999997 107.522 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 23.4 ttmm -101.6 125.44 48.26 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 124.288 1.035 . . . . 72.219999999999999 108.629 -176.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . 0.545 HG21 ' HE3' ' A' ' 98' ' ' LYS . 28.8 m -105.53 111.22 23.84 Favored 'General case' 0 C--O 1.24 0.58 0 N-CA-C 108.594 -0.891 . . . . 64.430000000000007 108.594 -179.189 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 83.0 mt -100.43 139.35 36.23 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.966 0.906 . . . . 73.120000000000005 111.112 -174.514 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 39.2 p -70.48 130.4 41.77 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 124.372 1.045 . . . . 64.129999999999995 110.165 176.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 43.5 p -118.21 152.76 51.03 Favored Pre-proline 0 CA--C 1.546 0.802 0 C-N-CA 123.177 0.591 . . . . 63.310000000000002 110.185 -174.62 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.86 8.33 3.49 Favored 'Trans proline' 0 C--N 1.377 2.031 0 C-N-CA 122.911 2.407 . . . . 64.450000000000003 112.615 172.299 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.4 m-20 -90.42 123.57 34.25 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.333 1.053 . . . . 73.420000000000002 109.073 -178.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.509 ' HG2' HD22 ' A' ' 28' ' ' ASN . 45.5 tt0 -77.87 130.77 37.04 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.399 0.68 . . . . 74.239999999999995 110.731 -177.621 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.509 HD22 ' HG2' ' A' ' 27' ' ' GLU . 51.2 m-80 59.1 25.11 13.51 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 124.637 1.175 . . . . 71.150000000000006 112.263 -173.718 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.507 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -142.02 139.48 32.37 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 123.382 0.673 . . . . 72.109999999999999 109.686 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.4 tp -148.34 138.04 22.25 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 122.733 0.413 . . . . 72.310000000000002 110.555 -173.324 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 83.0 tttt -85.9 123.78 31.63 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.374 0.669 . . . . 75.219999999999999 111.814 -174.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -110.34 110.6 21.45 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 107.174 -1.417 . . . . 51.409999999999997 107.174 170.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.3 tp -106.08 129.62 54.14 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 124.331 1.052 . . . . 70.450000000000003 110.24 -167.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.9 m -77.51 104.99 8.36 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.995 -0.743 . . . . 72.120000000000005 108.995 174.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.5 p -113.09 10.56 18.73 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.552 0.741 . . . . 64.25 111.278 -177.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.439 ' HB2' HH22 ' A' ' 15' ' ' ARG . 6.2 p-10 -75.34 -26.7 58.8 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.379 0.672 . . . . 64.439999999999998 110.902 -179.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.71 -36.96 1.92 Allowed Glycine 0 C--N 1.334 0.419 0 N-CA-C 110.395 -1.082 . . . . 70.430000000000007 110.395 -176.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -78.2 161.41 27.34 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 122.026 0.917 . . . . 74.040000000000006 111.446 174.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.447 ' HE1' ' HG2' ' A' ' 43' ' ' ARG . 85.0 mtp -117.97 142.53 47.26 Favored 'General case' 0 C--O 1.243 0.727 0 N-CA-C 106.376 -1.713 . . . . 62.329999999999998 106.376 170.634 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 82.5 mt -55.29 -45.22 76.24 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.842 0.457 . . . . 71.040000000000006 112.021 -175.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.612 ' NE2' ' HB ' ' A' ' 116' ' ' ILE . 33.2 tt0 -133.74 145.55 49.94 Favored 'General case' 0 C--O 1.243 0.737 0 C-N-CA 124.333 1.053 . . . . 75.25 108.789 -177.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 9.4 m -64.35 146.57 54.22 Favored 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 123.086 0.554 . . . . 43.140000000000001 109.899 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.447 ' HG2' ' HE1' ' A' ' 39' ' ' MET . 99.5 mtt180 -58.5 -5.04 0.47 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 116.359 1.985 . . . . 71.129999999999995 116.359 -161.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -87.2 54.28 4.5 Favored Glycine 0 CA--C 1.533 1.176 0 N-CA-C 111.157 -0.777 . . . . 73.349999999999994 111.157 165.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.1 m -97.01 169.1 10.06 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.768 0.827 . . . . 75.400000000000006 111.009 -176.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 99.5 mttt -120.05 178.02 4.77 Favored 'General case' 0 N--CA 1.478 0.939 0 N-CA-C 108.115 -1.069 . . . . 53.229999999999997 108.115 168.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 23.1 p -87.87 71.8 9.44 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 107.603 -1.258 . . . . 64.340000000000003 107.603 167.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.568 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 55.9 mt -72.42 104.49 1.89 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.714 0 CA-C-N 115.323 -0.853 . . . . 51.210000000000001 109.817 -167.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 77' ' ' LEU . 60.2 t -87.63 109.59 19.69 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 N-CA-C 108.806 -0.813 . . . . 53.039999999999999 108.806 -178.098 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.461 HD11 HD11 ' A' ' 116' ' ' ILE . 52.5 mt -109.41 112.37 40.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 N-CA-C 108.674 -0.862 . . . . 71.120000000000005 108.674 178.522 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 45.5 mtpt -86.47 162.01 18.31 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 109.39 -0.596 . . . . 73.420000000000002 109.39 173.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.8 p-10 -59.06 -24.75 63.15 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.41 1.084 . . . . 72.239999999999995 112.332 178.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 7.1 t -81.63 -18.23 45.39 Favored 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 123.073 0.549 . . . . 52.130000000000003 111.196 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -90.0 68.28 7.23 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.971 0.908 . . . . 73.219999999999999 111.115 -178.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -60.02 -27.27 66.76 Favored 'General case' 0 N--CA 1.486 1.346 0 C-N-CA 123.453 0.701 . . . . 73.319999999999993 110.994 176.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -60.37 -40.21 90.02 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 122.927 0.491 . . . . 72.120000000000005 111.355 177.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.442 ' HB2' HG23 ' A' ' 50' ' ' ILE . 87.1 mt -81.24 -35.7 30.88 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.808 0.843 . . . . 60.100000000000001 111.748 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 83.0 mt -63.22 -35.09 70.6 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.301 0 C-N-CA 123.771 0.828 . . . . 44.399999999999999 109.836 176.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.0 t-20 -63.02 -28.1 69.87 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 124.755 1.222 . . . . 42.149999999999999 111.663 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 23.6 m170 -82.02 -7.35 59.61 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.48 0.712 . . . . 72.310000000000002 111.926 177.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.481 ' HB2' HG12 ' A' ' 116' ' ' ILE . 39.2 t -135.74 101.77 4.87 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.895 0.478 . . . . 73.329999999999998 111.013 -171.08 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 17.0 tppt? -54.76 -36.32 64.73 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.241 0.616 . . . . 52.140000000000001 110.648 170.7 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.567 ' HB2' ' HG3' ' A' ' 108' ' ' GLN . 27.2 tp -63.61 -44.08 95.0 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 123.261 0.624 . . . . 73.019999999999996 111.155 177.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.69 -42.03 98.07 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.901 0.48 . . . . 55.329999999999998 111.099 179.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 -54.43 -48.41 71.69 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 124.144 0.902 . . . . 53.140000000000001 110.475 175.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.544 ' HB3' HD22 ' A' ' 104' ' ' LEU . 27.9 mm-40 -63.68 -41.08 98.2 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.167 0.987 . . . . 73.349999999999994 113.101 178.405 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.544 HG21 HD21 ' A' ' 77' ' ' LEU . 95.9 mt -64.68 -53.22 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.151 0 C-N-CA 123.472 0.709 . . . . 72.340000000000003 111.164 -178.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -68.49 -27.75 66.4 Favored 'General case' 0 N--CA 1.475 0.819 0 O-C-N 123.415 0.447 . . . . 71.5 111.416 -179.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -66.55 -58.58 4.9 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.182 0.593 . . . . 54.140000000000001 110.739 177.008 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.467 ' NE2' HD21 ' A' ' 104' ' ' LEU . 78.7 mt-30 -79.21 -26.59 42.55 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-N 115.765 -0.652 . . . . 62.049999999999997 112.139 -174.057 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 79.5 m -133.08 86.85 41.29 Favored Pre-proline 0 CA--C 1.548 0.891 0 N-CA-C 108.904 -0.776 . . . . 62.130000000000003 108.904 -178.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -73.88 -7.08 19.56 Favored 'Trans proline' 0 C--N 1.369 1.641 0 C-N-CA 122.933 2.422 . . . . 65.230000000000004 112.644 179.559 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.23 -15.28 81.71 Favored Glycine 0 C--N 1.347 1.19 0 CA-C-N 116.221 -0.445 . . . . 65.140000000000001 113.138 178.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 68.0 t -73.39 121.8 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.566 0 N-CA-C 108.683 -0.858 . . . . 52.100000000000001 108.683 174.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -90.95 -28.67 17.9 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 115.9 -0.591 . . . . 71.219999999999999 110.904 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.7 t -161.65 161.63 29.63 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-O 121.591 0.71 . . . . 73.040000000000006 111.536 -171.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.544 HD21 HG21 ' A' ' 67' ' ' ILE . 84.6 mt -126.06 150.94 47.78 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 124.734 1.214 . . . . 75.099999999999994 108.228 177.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.575 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 51.3 ttm -125.01 104.15 8.4 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 107.028 -1.471 . . . . 73.209999999999994 107.028 168.084 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.714 HD13 HD13 ' A' ' 84' ' ' LEU . 34.2 mm -86.82 132.76 31.57 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 N-CA-C 108.524 -0.917 . . . . 72.239999999999995 108.524 -175.436 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -121.14 -170.58 14.05 Favored Glycine 0 C--O 1.245 0.834 0 N-CA-C 110.901 -0.88 . . . . 53.219999999999999 110.901 174.862 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -67.02 -55.06 16.05 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-O 122.04 0.924 . . . . 74.530000000000001 109.707 179.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 2.8 p-10 -118.03 0.98 11.96 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 114.513 -1.221 . . . . 74.230000000000004 111.705 -172.066 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 46.3 p90 -140.52 166.26 25.21 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.351 0.596 . . . . 73.439999999999998 111.661 -170.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.714 HD13 HD13 ' A' ' 79' ' ' ILE . 17.3 tp -141.65 116.56 9.86 Favored 'General case' 0 CA--C 1.529 0.158 0 CA-C-N 114.368 -1.287 . . . . 53.229999999999997 108.601 176.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.575 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 14.1 m -100.61 111.56 23.82 Favored 'General case' 0 CA--C 1.539 0.55 0 N-CA-C 108.261 -1.015 . . . . 74.010000000000005 108.261 179.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.507 ' O ' ' HA ' ' A' ' 29' ' ' ALA . 43.2 mm -86.31 125.88 40.69 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 109.244 -0.65 . . . . 73.329999999999998 109.244 -174.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 29.4 m-80 -110.57 118.7 36.94 Favored 'General case' 0 N--CA 1.469 0.506 0 N-CA-C 107.976 -1.12 . . . . 65.450000000000003 107.976 179.378 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.417 ' HG2' ' O ' ' A' ' 89' ' ' ASP . 0.0 OUTLIER -130.37 170.86 13.6 Favored 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 120.953 0.406 . . . . 71.340000000000003 111.205 -174.075 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.417 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 16.6 t70 -71.7 148.99 45.89 Favored 'General case' 0 CA--C 1.549 0.923 0 CA-C-N 115.092 -0.958 . . . . 74.329999999999998 110.638 174.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 18.1 ptp180 -62.69 -24.11 67.48 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.309 1.044 . . . . 74.019999999999996 113.03 -175.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 86.8 mtp -80.11 -14.75 58.26 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 122.847 0.459 . . . . 72.329999999999998 111.784 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.84 124.09 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.543 0.737 . . . . 62.0 109.262 -175.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 16.4 m170 -89.18 142.47 27.62 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.489 0.716 . . . . 62.549999999999997 110.749 -172.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 28.2 m95 -58.81 -33.75 70.73 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.832 0.853 . . . . 73.349999999999994 112.442 178.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -61.62 -23.59 66.14 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.206 0.602 . . . . 52.030000000000001 112.277 -179.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 26.5 m -91.61 -17.89 24.86 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.463 0.705 . . . . 74.25 111.849 177.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 87.1 mt -96.29 -50.8 11.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 123.894 0.878 . . . . 74.230000000000004 111.198 -171.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.545 ' HE3' HG21 ' A' ' 21' ' ' THR . 57.7 mtpt -56.15 -57.51 22.0 Favored Pre-proline 0 CA--C 1.551 0.988 0 CA-C-O 117.436 -1.269 . . . . 74.329999999999998 113.565 -167.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -59.59 -36.51 92.4 Favored 'Trans proline' 0 C--N 1.395 2.999 0 C-N-CA 121.978 1.786 . . . . 60.119999999999997 111.842 -174.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.482 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 6.3 mm-40 -66.59 -49.83 65.05 Favored 'General case' 0 CA--C 1.539 0.556 0 CA-C-N 114.917 -1.038 . . . . 65.439999999999998 110.928 -177.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 24.4 mt -75.48 -29.88 21.53 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 C-N-CA 123.209 0.604 . . . . 70.230000000000004 111.502 -175.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.54 HG23 ' HB ' ' A' ' 19' ' ' ILE . 93.7 mt -60.2 -42.54 90.67 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 CA-C-O 121.108 0.48 . . . . 73.010000000000005 109.795 170.442 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -63.63 -40.06 95.92 Favored 'General case' 0 N--CA 1.478 0.935 0 CA-C-N 114.926 -1.034 . . . . 72.409999999999997 110.852 176.39 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.544 HD22 ' HB3' ' A' ' 66' ' ' GLN . 98.5 mt -66.57 -38.37 86.91 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.622 0.769 . . . . 73.230000000000004 112.53 178.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.6 HD11 HD23 ' A' ' 84' ' ' LEU . 10.0 mp -65.38 -24.24 67.17 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 122.621 0.369 . . . . 41.439999999999998 110.802 174.575 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.532 HG23 ' HB ' ' A' ' 17' ' ' ILE . 89.2 m -81.69 -37.16 27.82 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.569 0.747 . . . . 72.049999999999997 109.612 177.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -63.21 -46.62 86.17 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.436 0.695 . . . . 70.099999999999994 111.138 175.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.567 ' HG3' ' HB2' ' A' ' 63' ' ' LEU . 0.6 OUTLIER -64.09 -56.97 11.12 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.002 0.921 . . . . 65.109999999999999 110.3 -175.027 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.488 ' HB2' HD13 ' A' ' 17' ' ' ILE . 97.1 mt -68.54 -12.63 61.54 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 115.761 -0.654 . . . . 63.439999999999998 112.279 -176.292 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -88.06 -49.54 6.97 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 122.863 0.465 . . . . 74.439999999999998 111.268 174.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -92.49 -16.53 25.68 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 122.649 0.379 . . . . 75.129999999999995 111.855 -170.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -134.13 -135.66 3.57 Favored Glycine 0 C--N 1.335 0.476 0 N-CA-C 110.893 -0.883 . . . . 41.049999999999997 110.893 -178.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -160.85 -60.18 0.06 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.613 0.765 . . . . 64.120000000000005 110.071 -175.594 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -92.44 141.9 28.02 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.738 0.815 . . . . 43.43 110.087 -178.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.505 HG21 HD12 ' A' ' 79' ' ' ILE . 6.0 p -71.44 -43.27 72.81 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.711 0 N-CA-C 108.573 -0.899 . . . . 64.109999999999999 108.573 168.109 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.612 ' HB ' ' NE2' ' A' ' 41' ' ' GLN . 83.3 mt -139.66 134.07 38.11 Favored 'Isoleucine or valine' 0 C--O 1.243 0.748 0 C-N-CA 124.957 1.303 . . . . 53.130000000000003 107.757 178.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 12.8 p -74.34 82.59 1.9 Allowed 'General case' 0 CA--C 1.549 0.929 0 CA-C-O 121.509 0.671 . . . . 74.420000000000002 109.395 171.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 26.7 tptp -81.17 77.65 8.04 Favored 'General case' 0 C--N 1.351 0.654 0 N-CA-C 107.772 -1.195 . . . . 63.539999999999999 107.772 178.359 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 . . . . . 0 C--O 1.246 0.903 0 N-CA-C 108.126 -1.065 . . . . 54.549999999999997 108.126 -170.547 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.7 pmm? . . . . . 0 N--CA 1.478 0.949 0 N-CA-C 109.978 -0.378 . . . . 74.329999999999998 109.978 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 155.9 109.53 0.31 Allowed Glycine 0 C--N 1.35 1.331 0 CA-C-O 119.863 -0.41 . . . . 74.019999999999996 112.875 177.244 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 67.1 m170 -121.38 112.17 18.22 Favored 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 124.008 0.923 . . . . 64.349999999999994 109.379 172.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 52.5 p-80 -170.75 144.11 2.23 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.088 0.955 . . . . 72.120000000000005 109.452 170.653 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 36.1 m80 -124.77 -172.68 2.62 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.618 0.767 . . . . 71.430000000000007 109.529 177.23 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 53.9 m80 -133.94 140.43 46.76 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 123.85 0.86 . . . . 73.150000000000006 109.219 177.729 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 61.5 m80 -88.38 121.09 30.38 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.675 0.79 . . . . 72.219999999999999 110.42 -179.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 47.1 p-80 -91.47 130.21 37.34 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 109.006 -0.739 . . . . 73.439999999999998 109.006 172.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 18.3 p -150.23 113.52 4.9 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.657 0.783 . . . . 72.420000000000002 110.073 -176.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.8 p80 -153.08 147.1 25.46 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.264 0.626 . . . . 71.549999999999997 109.868 -179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 23.2 ptm -147.34 126.77 13.17 Favored 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 107.879 -1.156 . . . . 72.519999999999996 107.879 175.379 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 -61.3 103.46 0.3 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.147 0.579 . . . . 62.409999999999997 109.605 -176.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 21.7 p -129.49 45.64 2.77 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.938 0.895 . . . . 60.450000000000003 111.218 -168.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -71.44 91.94 1.06 Allowed 'General case' 0 CA--C 1.552 1.042 0 N-CA-C 109.376 -0.602 . . . . 74.340000000000003 109.376 173.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -73.8 152.95 40.15 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 123.88 0.872 . . . . 74.25 110.302 -177.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.457 HD23 ' H ' ' A' ' 16' ' ' LEU . 2.3 pt? -126.65 169.34 13.22 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 123.197 0.599 . . . . 74.099999999999994 110.524 -179.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.403 HG13 ' HB2' ' A' ' 109' ' ' LEU . 11.6 mm -79.58 123.18 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.61 0 C-N-CA 124.024 0.93 . . . . 73.140000000000001 110.557 -166.611 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.488 ' HB2' ' O ' ' A' ' 35' ' ' THR . 5.0 m170 -87.89 138.05 31.79 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 107.728 -1.212 . . . . 72.019999999999996 107.728 174.238 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.521 ' HB ' HG23 ' A' ' 102' ' ' ILE . 51.4 mm -123.06 116.45 48.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 107.848 -1.168 . . . . 62.5 107.848 -176.053 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.606 ' HE3' HD21 ' A' ' 22' ' ' LEU . 62.6 tttp -100.12 125.77 46.27 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.167 1.387 . . . . 72.239999999999995 108.955 -172.493 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 89.5 m -93.77 112.01 23.8 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 108.679 -0.86 . . . . 63.520000000000003 108.679 -179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.606 HD21 ' HE3' ' A' ' 20' ' ' LYS . 93.9 mt -106.31 136.59 45.77 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 123.737 0.815 . . . . 75.239999999999995 109.49 177.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 34.6 p -89.16 143.25 26.98 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.635 0.774 . . . . 71.420000000000002 110.405 179.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 46.7 p -119.98 154.24 55.42 Favored Pre-proline 0 CA--C 1.557 1.247 0 C-N-CA 124.377 1.071 . . . . 74.230000000000004 109.278 -177.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 88.1 Cg_exo -49.7 -45.97 29.27 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 123.571 2.847 . . . . 74.109999999999999 113.244 176.069 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.3 t30 -77.85 114.99 17.25 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.818 0.847 . . . . 71.25 109.145 175.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -75.38 -19.35 59.6 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 122.864 0.466 . . . . 50.329999999999998 111.436 -178.185 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.3 m120 -63.42 -27.18 69.12 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.914 0.886 . . . . 74.439999999999998 109.612 172.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.413 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -102.37 154.06 19.43 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.056 1.342 . . . . 75.420000000000002 110.94 176.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 43.3 tp -151.07 127.82 10.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.683 0.793 . . . . 70.150000000000006 108.884 170.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -90.17 138.19 31.73 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.326 0.65 . . . . 74.239999999999995 111.729 -174.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -123.49 126.25 46.38 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.699 1.2 . . . . 74.129999999999995 108.638 171.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.6 tp -117.05 125.72 51.76 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 124.269 1.027 . . . . 73.409999999999997 108.656 179.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.4 p -80.59 107.07 13.09 Favored 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 108.848 -0.797 . . . . 71.120000000000005 108.848 176.448 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.488 ' O ' ' HB2' ' A' ' 18' ' ' HIS . 26.0 p -106.87 127.43 53.41 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 125.009 1.324 . . . . 71.519999999999996 108.638 -177.894 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 16.7 m-20 57.99 73.79 0.45 Allowed 'General case' 0 N--CA 1.487 1.418 0 C-N-CA 124.349 1.06 . . . . 75.430000000000007 109.943 -176.634 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -175.82 -130.05 1.28 Allowed Glycine 0 N--CA 1.447 -0.629 0 CA-C-N 114.277 -1.328 . . . . 34.240000000000002 110.474 -176.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -129.4 156.26 44.36 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.818 0.847 . . . . 73.200000000000003 109.753 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 15.7 ttt -78.4 144.99 35.4 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.489 0.716 . . . . 61.130000000000003 110.776 -171.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.486 HD13 ' HB2' ' A' ' 84' ' ' LEU . 96.3 mt -70.73 -39.27 73.47 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.52 0.728 . . . . 71.040000000000006 112.2 -175.345 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.544 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 8.9 tp-100 -147.83 149.94 33.25 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 123.949 0.899 . . . . 74.540000000000006 109.031 -176.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.427 HG22 ' H ' ' A' ' 44' ' ' GLY . 47.5 m -73.14 140.73 47.28 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.036 0.535 . . . . 74.340000000000003 110.154 176.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 83.4 mtm180 -63.66 -22.03 66.69 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.879 0.872 . . . . 72.519999999999996 112.266 -175.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . 0.427 ' H ' HG22 ' A' ' 42' ' ' THR . . . -64.61 -23.43 68.79 Favored Glycine 0 C--N 1.35 1.326 0 CA-C-O 120.046 -0.308 . . . . 74.349999999999994 113.713 176.021 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.7 m -90.15 166.68 13.25 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.785 0.834 . . . . 63.25 111.678 179.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 65.0 mttm -94.99 -172.95 2.83 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 124.217 1.007 . . . . 75.030000000000001 109.881 175.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 26.6 p -72.56 101.26 2.95 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.542 0.737 . . . . 73.340000000000003 110.189 174.316 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 53.9 mt -78.51 102.53 4.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 123.445 0.698 . . . . 73.150000000000006 109.72 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 40.5 t -90.19 108.71 19.81 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.726 0 N-CA-C 109.036 -0.728 . . . . 54.450000000000003 109.036 -176.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 72.2 mt -98.36 109.14 23.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.514 0 N-CA-C 108.593 -0.891 . . . . 61.439999999999998 108.593 -178.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -103.55 141.01 36.75 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.0 0.52 . . . . 73.219999999999999 110.007 -177.239 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.5 p-10 -62.37 -23.84 67.03 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.846 0.858 . . . . 54.420000000000002 112.842 -175.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.3 t -69.6 -35.62 75.48 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.35 0.66 . . . . 73.5 110.763 176.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -97.13 77.24 2.7 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 107.755 -1.202 . . . . 75.209999999999994 107.755 178.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.551 ' HA ' HD13 ' A' ' 58' ' ' ILE . 36.8 tt0 -66.34 -15.68 63.46 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 115.486 -0.779 . . . . 73.019999999999996 112.138 -172.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 29.5 p-10 -63.35 -38.02 89.52 Favored 'General case' 0 C--N 1.35 0.623 0 N-CA-C 110.09 -0.337 . . . . 71.549999999999997 110.09 173.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 86.4 mt -65.09 -36.43 84.27 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.593 0.757 . . . . 65.409999999999997 110.419 177.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.551 HD13 ' HA ' ' A' ' 55' ' ' GLU . 1.9 mp -61.73 -50.1 81.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 CA-C-N 115.063 -0.972 . . . . 54.240000000000002 109.026 173.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -65.87 -24.62 66.9 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.596 0.758 . . . . 64.140000000000001 112.016 -176.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 29.1 m170 -72.94 -39.07 66.54 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.795 0.438 . . . . 74.319999999999993 110.251 175.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.489 ' HA ' ' HA ' ' A' ' 116' ' ' ILE . 34.5 m -106.93 112.86 26.02 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 123.499 0.72 . . . . 74.239999999999995 111.614 -172.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -55.98 -39.09 71.3 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.201 0.6 . . . . 54.240000000000002 111.268 177.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.641 HD11 HD12 ' A' ' 105' ' ' LEU . 21.4 tp -61.62 -40.04 93.44 Favored 'General case' 0 N--CA 1.475 0.792 0 O-C-N 123.718 0.637 . . . . 70.120000000000005 111.065 179.372 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.409 ' HA ' HD11 ' A' ' 77' ' ' LEU . . . -65.94 -42.97 89.33 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.071 0.548 . . . . 64.109999999999999 111.003 179.446 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 -55.89 -50.69 69.97 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.259 0.624 . . . . 75.439999999999998 109.947 176.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.494 ' HB3' HD22 ' A' ' 104' ' ' LEU . 26.7 mm-40 -59.31 -50.66 73.15 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 124.441 1.096 . . . . 73.430000000000007 112.613 179.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 61.0 mt -66.85 -51.28 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.338 0 C-N-CA 123.354 0.662 . . . . 72.140000000000001 111.475 -174.109 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -67.18 -29.99 69.83 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.038 0.535 . . . . 74.439999999999998 111.827 -179.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 60.0 tp -70.07 -59.53 2.84 Favored 'General case' 0 N--CA 1.485 1.286 0 CA-C-O 120.883 0.373 . . . . 72.230000000000004 110.814 176.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 42.1 mt-30 -82.75 -10.51 58.86 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.578 0.751 . . . . 72.120000000000005 111.984 -170.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.485 ' SG ' HG12 ' A' ' 97' ' ' ILE . 44.4 t -145.49 84.08 8.64 Favored Pre-proline 0 CA--C 1.547 0.856 0 N-CA-C 108.696 -0.853 . . . . 65.450000000000003 108.696 169.393 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -69.91 2.64 3.44 Favored 'Trans proline' 0 C--N 1.381 2.278 0 C-N-CA 123.195 2.597 . . . . 53.109999999999999 113.817 179.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . 0.506 ' HA3' HG11 ' A' ' 92' ' ' VAL . . . -84.39 -1.44 89.35 Favored Glycine 0 C--N 1.349 1.259 0 N-CA-C 114.168 0.427 . . . . 72.010000000000005 114.168 176.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 89.3 t -85.45 132.07 32.74 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.894 0 C-N-CA 123.211 0.604 . . . . 64.409999999999997 109.443 174.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -84.01 -50.31 8.12 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.561 1.144 . . . . 71.0 110.875 176.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 75.8 p -155.02 155.5 34.27 Favored 'General case' 0 C--O 1.233 0.22 0 CA-C-N 115.61 -0.723 . . . . 73.120000000000005 110.955 -174.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.409 HD11 ' HA ' ' A' ' 64' ' ' ALA . 36.3 mt -106.85 148.58 28.37 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 107.378 -1.341 . . . . 74.120000000000005 107.378 170.556 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.57 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 50.6 ttm -125.32 101.08 6.8 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 106.6 -1.63 . . . . 74.150000000000006 106.6 167.287 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.78 HG21 HG11 ' A' ' 115' ' ' VAL . 18.2 mm -81.01 107.44 13.33 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 107.921 -1.14 . . . . 65.519999999999996 107.921 -178.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.53 170.38 36.88 Favored Glycine 0 C--O 1.245 0.805 0 N-CA-C 109.689 -1.364 . . . . 61.420000000000002 109.689 171.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.544 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 6.9 p-10 -59.64 -51.41 69.94 Favored 'General case' 0 CA--C 1.549 0.907 0 O-C-N 123.854 0.384 . . . . 73.439999999999998 110.588 179.818 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 10.8 p-10 -107.2 -30.46 8.74 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 123.01 0.524 . . . . 63.329999999999998 111.121 177.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -99.2 161.22 13.74 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 123.2 0.6 . . . . 75.120000000000005 111.876 -172.663 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.486 ' HB2' HD13 ' A' ' 40' ' ' LEU . 26.3 tp -134.24 112.04 10.74 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.747 0.819 . . . . 74.209999999999994 108.99 172.341 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.57 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 25.5 m -100.79 105.52 16.83 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 108.868 -0.79 . . . . 61.340000000000003 108.868 -177.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 29' ' ' ALA . 33.4 mm -88.26 124.97 41.61 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 N-CA-C 108.787 -0.819 . . . . 73.129999999999995 108.787 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 37.7 m-80 -110.31 123.77 50.44 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 108.193 -1.04 . . . . 71.219999999999999 108.193 177.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.456 ' HD2' ' CZ2' ' A' ' 94' ' ' TRP . 0.0 OUTLIER -117.52 178.33 4.43 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.051 0.54 . . . . 75.450000000000003 110.67 -173.199 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.402 ' O ' ' HG2' ' A' ' 88' ' ' LYS . 23.2 t70 -92.33 155.41 17.94 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 123.536 0.734 . . . . 72.299999999999997 110.432 173.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 16.2 ptt180 -58.26 -35.43 71.74 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.603 1.161 . . . . 71.219999999999999 113.635 -173.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 79.3 mtp -76.69 -21.38 55.45 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.847 0.459 . . . . 71.329999999999998 111.85 -175.641 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.506 HG11 ' HA3' ' A' ' 73' ' ' GLY . 10.9 t -103.21 121.08 54.04 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 108.824 -0.806 . . . . 74.439999999999998 108.824 -173.881 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 8.4 t-160 -101.61 150.88 22.64 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.042 0.937 . . . . 75.150000000000006 109.271 -171.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.456 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 85.6 m95 -59.52 -15.71 19.77 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.893 1.071 . . . . 75.5 113.893 -172.386 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -58.61 -39.24 79.88 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.698 0.799 . . . . 72.329999999999998 111.692 176.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 25.3 t -91.29 -12.99 33.48 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.666 0.787 . . . . 74.420000000000002 111.32 -176.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.485 HG12 ' SG ' ' A' ' 71' ' ' CYS . 59.6 mt -103.27 -54.79 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.398 0 C-N-CA 123.769 0.828 . . . . 74.019999999999996 111.253 -168.501 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 30.7 ttpt -54.34 -54.19 50.96 Favored Pre-proline 0 CA--C 1.566 1.596 0 C-N-CA 124.78 1.232 . . . . 63.329999999999998 113.494 -171.35 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -61.29 -36.12 80.98 Favored 'Trans proline' 0 C--N 1.401 3.318 0 C-N-CA 122.237 1.958 . . . . 74.150000000000006 112.237 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.474 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 15.6 mm-40 -62.65 -48.66 78.38 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 115.579 -0.737 . . . . 72.239999999999995 110.085 178.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.413 ' O ' HD13 ' A' ' 105' ' ' LEU . 50.9 mt -67.29 -41.79 86.94 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.786 0 C-N-CA 123.395 0.678 . . . . 73.109999999999999 111.755 -177.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.521 HG23 ' HB ' ' A' ' 19' ' ' ILE . 57.9 mt -56.82 -41.25 75.32 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 C-N-CA 123.112 0.565 . . . . 73.120000000000005 110.854 176.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 17.8 t70 -57.18 -52.13 66.54 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 123.46 0.704 . . . . 73.450000000000003 110.609 174.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.494 HD22 ' HB3' ' A' ' 66' ' ' GLN . 61.8 mt -64.04 -36.13 82.98 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.353 1.061 . . . . 54.210000000000001 112.316 -174.572 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.641 HD12 HD11 ' A' ' 63' ' ' LEU . 9.2 mp -69.88 -29.48 66.7 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.642 0.777 . . . . 53.539999999999999 111.028 177.814 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 50.3 m -78.14 -41.51 34.72 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 108.953 -0.758 . . . . 34.420000000000002 108.953 178.47 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 33.5 mmtp -58.32 -56.86 16.57 Favored 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 124.337 1.055 . . . . 71.140000000000001 111.218 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.493 ' OE1' ' HB2' ' A' ' 63' ' ' LEU . 28.9 tt0 -58.04 -50.32 73.83 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.72 0.808 . . . . 71.030000000000001 111.585 -173.743 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.403 ' HB2' HG13 ' A' ' 17' ' ' ILE . 82.4 mt -77.58 -18.07 57.23 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 115.049 -0.978 . . . . 64.120000000000005 111.639 -175.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -70.36 -42.57 71.64 Favored 'General case' 0 N--CA 1.489 1.512 0 C-N-CA 122.746 0.419 . . . . 62.439999999999998 110.401 173.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 31.9 m-85 -72.9 -19.33 61.29 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 115.858 -0.61 . . . . 74.319999999999993 110.361 172.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.81 59.58 2.77 Favored Glycine 0 C--N 1.344 1.022 0 CA-C-N 115.729 -0.669 . . . . 32.130000000000003 112.413 173.328 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -137.12 157.27 47.07 Favored 'General case' 0 C--O 1.245 0.819 0 C-N-CA 123.12 0.568 . . . . 73.200000000000003 110.119 177.704 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.0 t70 -80.68 160.46 24.99 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.803 1.241 . . . . 73.430000000000007 110.177 177.447 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.78 HG11 HG21 ' A' ' 79' ' ' ILE . 2.1 p -50.5 -50.31 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 124.521 1.129 . . . . 75.340000000000003 112.478 178.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.497 HD12 HG13 ' A' ' 115' ' ' VAL . 2.1 mp -74.94 -66.78 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 N-CA-C 108.625 -0.88 . . . . 61.240000000000002 108.625 175.448 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 53.2 m -148.31 -86.5 0.09 Allowed 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.274 0.629 . . . . 64.239999999999995 110.25 -176.21 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.6 mtpm? -139.22 -50.05 0.51 Allowed 'General case' 0 N--CA 1.486 1.363 0 N-CA-C 109.198 -0.667 . . . . 72.430000000000007 109.198 -178.082 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 . . . . . 0 C--O 1.251 1.132 0 N-CA-C 108.32 -0.992 . . . . 71.430000000000007 108.32 -176.026 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 mmt . . . . . 0 N--CA 1.477 0.88 0 N-CA-C 109.997 -0.371 . . . . 74.549999999999997 109.997 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -167.16 -144.17 4.03 Favored Glycine 0 C--N 1.336 0.556 0 N-CA-C 111.183 -0.767 . . . . 53.240000000000002 111.183 177.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.2 m-70 57.81 27.89 15.16 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.187 0.995 . . . . 71.200000000000003 112.531 172.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 15.3 p80 -69.24 114.41 7.47 Favored 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 109.488 -0.56 . . . . 74.0 109.488 -178.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -94.52 138.27 32.63 Favored 'General case' 0 C--O 1.24 0.554 0 C-N-CA 123.607 0.763 . . . . 74.0 109.098 -178.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 40.3 t-80 -144.27 122.3 12.1 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 109.265 -0.643 . . . . 75.099999999999994 109.265 -178.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 75.6 m80 -64.13 130.01 42.24 Favored 'General case' 0 C--O 1.24 0.557 0 O-C-N 123.871 0.732 . . . . 72.209999999999994 109.697 174.503 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 34.5 m80 -73.11 90.11 1.53 Allowed 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 108.567 -0.901 . . . . 65.310000000000002 108.567 178.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.4 t -58.92 98.52 0.04 OUTLIER 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.288 1.035 . . . . 53.350000000000001 110.981 -176.764 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 32.9 m170 -99.29 156.39 17.01 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.661 0.784 . . . . 73.319999999999993 110.581 -179.519 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 19.3 ptp -133.8 175.13 9.73 Favored 'General case' 0 C--O 1.243 0.747 0 CA-C-N 115.024 -0.989 . . . . 63.340000000000003 108.794 172.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.5 m-20 -70.4 114.68 8.76 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.818 -0.628 . . . . 63.109999999999999 109.967 177.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.2 m -72.91 91.82 1.57 Allowed 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.476 0.71 . . . . 62.43 109.509 176.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 13.8 mm100 -91.41 151.55 20.77 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.512 0.725 . . . . 63.439999999999998 111.22 -173.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 21.2 tpp180 -89.75 96.97 10.93 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.804 -0.634 . . . . 73.340000000000003 109.988 -178.339 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -147.62 129.37 15.17 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.014 -1.476 . . . . 74.439999999999998 107.014 168.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.415 ' HB ' HG23 ' A' ' 106' ' ' THR . 72.9 mt -67.73 125.11 24.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 C-N-CA 122.986 0.514 . . . . 71.409999999999997 110.816 -177.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 81.1 m-70 -65.88 121.93 16.17 Favored 'General case' 0 C--O 1.242 0.666 0 O-C-N 123.902 0.751 . . . . 73.200000000000003 109.982 172.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 47.6 mm -127.16 116.59 44.79 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 N-CA-C 105.915 -1.883 . . . . 73.420000000000002 105.915 172.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -101.69 151.75 21.66 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.83 -1.174 . . . . 71.040000000000006 107.83 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 16.8 m -122.7 112.61 18.15 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 109.202 -0.666 . . . . 74.129999999999995 109.202 175.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.7 mt -86.72 139.46 30.72 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.701 0.8 . . . . 42.539999999999999 110.086 176.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 19.2 p -78.77 144.7 34.91 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.525 0.73 . . . . 73.430000000000007 109.344 172.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 14.9 p -122.98 162.68 37.8 Favored Pre-proline 0 CA--C 1.544 0.732 0 C-N-CA 124.332 1.053 . . . . 74.230000000000004 109.667 -174.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 7.8 Cg_exo -75.81 43.77 1.16 Allowed 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 123.008 2.472 . . . . 74.329999999999998 112.448 171.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 46.7 t-20 -155.79 138.47 15.15 Favored 'General case' 0 CA--C 1.541 0.631 0 N-CA-C 108.763 -0.829 . . . . 70.450000000000003 108.763 -176.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -81.39 -43.12 19.44 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.545 0.738 . . . . 63.140000000000001 110.876 178.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -67.53 -45.42 75.79 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.894 0.877 . . . . 71.109999999999999 110.31 -178.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -89.55 132.19 35.2 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 123.41 0.684 . . . . 54.210000000000001 110.907 -178.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 46.8 tp -135.49 128.9 32.26 Favored 'General case' 0 N--CA 1.484 1.261 0 N-CA-C 108.382 -0.97 . . . . 73.340000000000003 108.382 172.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -93.11 118.2 30.94 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 123.437 0.695 . . . . 63.439999999999998 111.5 -171.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -103.39 116.69 32.9 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 124.306 1.042 . . . . 61.310000000000002 108.25 172.487 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 55.7 tp -104.18 127.65 51.81 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.639 0.776 . . . . 71.129999999999995 110.088 -178.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.4 t -83.69 115.95 22.42 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.749 -0.834 . . . . 71.209999999999994 108.749 174.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 71.4 p -107.47 -43.46 4.53 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 122.825 0.45 . . . . 73.329999999999998 112.02 -171.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 35.1 t70 -102.1 -24.95 13.89 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 112.575 0.583 . . . . 75.329999999999998 112.575 -174.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . 0.403 ' HA3' HD13 ' A' ' 109' ' ' LEU . . . -81.75 -140.51 3.18 Favored Glycine 0 C--N 1.34 0.795 0 C-N-CA 121.603 -0.332 . . . . 74.120000000000005 112.504 -175.747 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.515 ' HB2' HD22 ' A' ' 109' ' ' LEU . 41.0 mt-10 -99.24 -171.67 2.12 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.398 0.679 . . . . 62.409999999999997 109.763 179.111 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 13.9 ttt -106.93 143.37 35.13 Favored 'General case' 0 CA--C 1.54 0.576 0 N-CA-C 108.364 -0.976 . . . . 73.040000000000006 108.364 177.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 86.0 mt -75.02 -56.61 4.56 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.561 0.744 . . . . 73.540000000000006 111.371 -174.683 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.472 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.7 tp-100 -129.94 171.38 12.82 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 124.378 1.071 . . . . 73.129999999999995 109.127 -173.603 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 22.0 m -58.12 134.1 56.17 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 124.518 1.127 . . . . 72.230000000000004 111.759 176.496 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -59.19 124.6 20.51 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.246 1.019 . . . . 70.420000000000002 112.67 -171.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 65.45 33.85 87.6 Favored Glycine 0 C--N 1.351 1.412 0 O-C-N 123.643 0.589 . . . . 72.230000000000004 113.923 175.501 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.7 t -89.34 -178.0 5.51 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.339 0.656 . . . . 75.540000000000006 109.329 174.595 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -77.02 127.87 33.47 Favored 'General case' 0 CA--C 1.549 0.925 0 N-CA-C 109.585 -0.524 . . . . 74.340000000000003 109.585 174.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 58.0 p -65.25 119.59 11.18 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 124.042 0.937 . . . . 72.230000000000004 111.502 -179.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 4.0 mp -79.97 109.7 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.132 0.973 . . . . 70.430000000000007 109.028 -177.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 96.4 t -91.94 114.81 29.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 N-CA-C 108.664 -0.865 . . . . 53.439999999999998 108.664 178.403 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 70.4 mt -110.19 111.2 35.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.574 0 N-CA-C 108.373 -0.973 . . . . 55.030000000000001 108.373 179.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -89.15 172.53 9.02 Favored 'General case' 0 N--CA 1.478 0.975 0 CA-C-O 120.975 0.417 . . . . 74.150000000000006 110.25 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.8 p-10 -65.24 -23.35 67.04 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.649 0.78 . . . . 73.319999999999993 110.935 170.582 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 41.2 p -79.45 -25.18 42.02 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 123.913 0.885 . . . . 60.219999999999999 111.145 175.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.409 ' O ' HG13 ' A' ' 58' ' ' ILE . 15.9 m-20 -83.86 55.91 3.46 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.643 0.777 . . . . 54.520000000000003 110.264 176.106 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -56.28 -35.79 67.88 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.81 0.844 . . . . 75.129999999999995 111.37 179.677 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -57.85 -42.67 84.92 Favored 'General case' 0 CA--C 1.547 0.849 0 C-N-CA 124.123 0.969 . . . . 71.439999999999998 110.924 176.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 79.9 mt -79.13 -29.38 43.14 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.717 -0.674 . . . . 72.349999999999994 111.022 -178.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.409 HG13 ' O ' ' A' ' 54' ' ' ASP . 76.2 mt -63.36 -50.98 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.418 0 C-N-CA 123.228 0.611 . . . . 62.509999999999998 109.557 175.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 45.5 m-80 -59.9 -32.14 70.46 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.294 0.638 . . . . 52.130000000000003 110.572 176.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.409 ' HD2' HG23 ' A' ' 116' ' ' ILE . 5.9 t60 -78.34 -15.45 58.7 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 122.725 0.41 . . . . 73.530000000000001 111.68 -177.432 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 56.8 p -124.39 113.86 18.74 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 122.71 0.404 . . . . 74.150000000000006 110.881 -178.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? -53.51 -47.43 69.9 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 125.138 1.375 . . . . 74.109999999999999 112.105 -176.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.46 ' HB2' ' OE1' ' A' ' 108' ' ' GLN . 24.9 tp -62.01 -39.99 94.15 Favored 'General case' 0 CA--C 1.544 0.724 0 CA-C-N 115.143 -0.935 . . . . 73.120000000000005 111.97 -176.22 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.36 -45.58 93.0 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.245 0.618 . . . . 35.340000000000003 111.406 -177.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 -54.69 -46.14 74.06 Favored 'General case' 0 N--CA 1.477 0.883 0 O-C-N 124.515 1.134 . . . . 72.040000000000006 110.863 179.787 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.418 ' HB3' HD22 ' A' ' 104' ' ' LEU . 18.3 mm100 -63.52 -45.54 90.15 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.108 0.963 . . . . 61.509999999999998 112.137 179.495 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.8 mt -65.11 -47.51 87.44 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.115 0 C-N-CA 123.119 0.568 . . . . 75.409999999999997 111.171 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -65.65 -31.84 73.09 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.305 0.642 . . . . 64.409999999999997 111.501 176.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 58.7 tp -66.34 -57.3 7.77 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.287 0.635 . . . . 55.409999999999997 111.063 178.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 -72.2 -29.16 63.71 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.836 -0.62 . . . . 74.129999999999995 111.546 -174.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.548 ' SG ' ' HA ' ' A' ' 97' ' ' ILE . 63.6 m -137.73 88.58 16.09 Favored Pre-proline 0 CA--C 1.547 0.857 0 N-CA-C 108.938 -0.764 . . . . 71.209999999999994 108.938 -179.161 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.79 -3.89 12.95 Favored 'Trans proline' 0 C--N 1.379 2.156 0 C-N-CA 123.052 2.501 . . . . 62.109999999999999 113.676 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -77.71 -15.72 80.96 Favored Glycine 0 C--N 1.352 1.418 0 O-C-N 123.196 0.31 . . . . 63.329999999999998 112.851 176.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.511 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 95.7 t -67.23 122.27 17.97 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 123.372 0.669 . . . . 52.219999999999999 109.649 175.687 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -83.31 -44.93 14.36 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.807 0.843 . . . . 74.109999999999999 110.739 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 61.5 p -155.01 170.92 20.65 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 121.511 0.672 . . . . 63.299999999999997 111.22 -176.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 78.8 mt -129.97 156.72 43.98 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 124.93 1.292 . . . . 62.229999999999997 108.661 178.374 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.562 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 50.8 ttm -130.09 100.54 5.46 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 107.303 -1.369 . . . . 70.329999999999998 107.303 170.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.479 HD12 HG21 ' A' ' 115' ' ' VAL . 40.7 mm -74.67 107.73 5.57 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 N-CA-C 107.547 -1.279 . . . . 73.450000000000003 107.547 176.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -79.66 -117.09 0.28 Allowed Glycine 0 C--N 1.34 0.777 0 N-CA-C 110.063 -1.215 . . . . 64.030000000000001 110.063 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.472 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 1.6 p-10 -149.32 -57.68 0.2 Allowed 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.093 0.557 . . . . 75.040000000000006 109.657 171.174 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 -83.69 -29.58 27.46 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 122.864 0.466 . . . . 65.430000000000007 109.791 170.89 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 30.6 p90 -116.47 170.3 8.67 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.982 0.913 . . . . 73.310000000000002 110.814 -174.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 46.0 tp -135.12 146.05 48.45 Favored 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 125.313 1.445 . . . . 72.230000000000004 107.471 171.456 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.562 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 35.5 m -127.71 130.18 48.4 Favored 'General case' 0 N--CA 1.469 0.524 0 N-CA-C 109.132 -0.692 . . . . 73.340000000000003 109.132 175.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 30.1 mm -108.16 128.51 63.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.681 0 N-CA-C 108.894 -0.78 . . . . 75.510000000000005 108.894 -178.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 64.2 m-20 -109.11 107.2 17.42 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 108.882 -0.784 . . . . 73.120000000000005 108.882 178.324 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -106.6 163.59 12.76 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.216 0.606 . . . . 75.120000000000005 109.716 -178.821 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -76.65 145.23 38.95 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 122.635 0.374 . . . . 72.439999999999998 110.282 175.288 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 17.4 ptt180 -58.89 -34.94 72.22 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.181 0.992 . . . . 74.150000000000006 112.869 -173.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.8 mmm -70.85 -26.02 63.08 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.124 0.57 . . . . 73.230000000000004 110.559 -175.414 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 11.5 t -91.77 142.3 13.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 N-CA-C 108.044 -1.095 . . . . 65.519999999999996 108.044 178.254 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 64.9 m80 -109.03 146.2 34.32 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.944 0.498 . . . . 73.129999999999995 111.116 -174.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . 0.494 ' CZ2' ' HD2' ' A' ' 88' ' ' LYS . 80.4 m95 -63.14 -13.54 38.0 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.054 0.941 . . . . 63.210000000000001 112.809 178.816 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 16.1 m120 -52.56 -39.71 61.78 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 124.173 0.989 . . . . 74.219999999999999 112.079 178.912 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 40.5 m -103.42 -0.53 29.88 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.366 0.667 . . . . 52.450000000000003 112.211 -176.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.548 ' HA ' ' SG ' ' A' ' 71' ' ' CYS . 57.2 mt -109.49 -50.83 6.82 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 C-N-CA 123.322 0.649 . . . . 61.149999999999999 111.275 -171.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.0 ttpm? -55.94 -51.74 78.08 Favored Pre-proline 0 CA--C 1.561 1.398 0 CA-C-O 117.778 -1.106 . . . . 74.510000000000005 113.28 -170.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 35.9 Cg_endo -61.02 -33.65 91.74 Favored 'Trans proline' 0 C--N 1.4 3.266 0 C-N-CA 121.799 1.666 . . . . 34.43 112.157 -177.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.419 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 8.0 mm-40 -65.36 -47.51 76.17 Favored 'General case' 0 C--N 1.343 0.295 0 CA-C-N 115.513 -0.767 . . . . 75.409999999999997 110.24 -178.736 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.1 mt -70.64 -37.97 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.042 0.537 . . . . 74.299999999999997 111.497 -177.835 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 97.9 mt -54.79 -44.37 71.17 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 N-CA-C 109.732 -0.47 . . . . 45.539999999999999 109.732 173.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.459 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 32.5 t70 -67.19 -40.74 86.55 Favored 'General case' 0 C--N 1.351 0.671 0 CA-C-N 115.039 -0.982 . . . . 72.420000000000002 111.181 179.746 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.419 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 95.9 mt -61.86 -39.96 93.68 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.803 0.841 . . . . 74.310000000000002 111.96 179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.451 HD12 HD11 ' A' ' 63' ' ' LEU . 10.9 mp -71.06 -21.26 62.27 Favored 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 115.597 -0.729 . . . . 74.530000000000001 110.628 176.731 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.415 HG23 ' HB ' ' A' ' 17' ' ' ILE . 24.0 m -81.73 -37.88 26.6 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 108.985 -0.746 . . . . 74.109999999999999 108.985 174.742 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 103' ' ' ASP . 11.0 mmpt? -59.33 -62.57 1.78 Allowed 'General case' 0 C--N 1.368 1.388 0 C-N-CA 124.041 0.936 . . . . 73.400000000000006 110.924 -178.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.46 ' OE1' ' HB2' ' A' ' 63' ' ' LEU . 25.9 tt0 -55.41 -47.13 76.39 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 124.658 1.224 . . . . 71.310000000000002 111.652 -171.72 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.515 HD22 ' HB2' ' A' ' 38' ' ' GLU . 82.7 mt -70.83 -30.62 67.09 Favored 'General case' 0 CA--C 1.55 0.964 0 CA-C-N 115.459 -0.791 . . . . 73.349999999999994 111.128 -178.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.39 -26.91 61.19 Favored 'General case' 0 N--CA 1.488 1.425 0 C-N-CA 123.016 0.526 . . . . 73.049999999999997 111.348 176.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 35.9 m-85 -72.77 -27.05 61.78 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 122.762 0.425 . . . . 71.329999999999998 110.148 170.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 91.59 36.02 6.67 Favored Glycine 0 C--N 1.346 1.117 0 N-CA-C 111.543 -0.623 . . . . 60.140000000000001 111.543 -177.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -120.54 159.57 24.94 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.155 0.982 . . . . 72.420000000000002 111.203 -173.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -110.9 174.02 6.06 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 124.338 1.055 . . . . 70.099999999999994 109.093 172.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.64 HG13 HD12 ' A' ' 116' ' ' ILE . 1.9 p -74.76 -55.81 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.974 0 N-CA-C 112.909 0.707 . . . . 72.219999999999999 112.909 -171.212 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.64 HD12 HG13 ' A' ' 115' ' ' VAL . 3.1 mp -71.54 98.59 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 CA-C-O 121.766 0.794 . . . . 74.450000000000003 108.88 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 51.4 p -99.29 -157.68 0.62 Allowed 'General case' 0 CA--C 1.555 1.163 0 C-N-CA 125.176 1.39 . . . . 73.540000000000006 110.335 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.403 ' HG3' ' HA ' ' A' ' 60' ' ' HIS . 75.1 mmtt 66.21 26.07 10.54 Favored 'General case' 0 N--CA 1.494 1.732 0 C-N-CA 125.0 1.32 . . . . 74.129999999999995 112.258 178.53 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 CA--C 1.558 1.259 0 C-N-CA 123.942 0.897 . . . . 63.109999999999999 109.385 -179.987 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.0 ptt? . . . . . 0 N--CA 1.488 1.431 0 N-CA-C 110.453 -0.202 . . . . 53.109999999999999 110.453 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.21 48.69 6.29 Favored Glycine 0 C--N 1.342 0.878 0 CA-C-N 116.16 -0.473 . . . . 44.25 113.307 176.256 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 23.7 m170 -75.48 99.75 4.3 Favored 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 109.481 -0.562 . . . . 74.549999999999997 109.481 173.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 42.0 p-80 -111.09 159.97 17.32 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 124.245 1.018 . . . . 72.439999999999998 110.762 -175.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 38.9 m80 -140.12 137.96 34.88 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.595 0.758 . . . . 65.400000000000006 109.723 177.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -138.81 134.73 33.79 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.047 0.939 . . . . 61.100000000000001 109.179 177.223 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.8 t-80 -68.94 99.49 1.07 Allowed 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.748 0.819 . . . . 74.319999999999993 111.685 -174.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 28.2 m170 -89.65 131.95 35.38 Favored 'General case' 0 C--O 1.243 0.725 0 N-CA-C 108.109 -1.071 . . . . 61.240000000000002 108.109 172.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 64.0 p -79.61 127.36 32.07 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.996 0.518 . . . . 74.239999999999995 110.615 -178.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 28.1 p-80 -98.35 150.68 21.33 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.0 0.52 . . . . 61.329999999999998 109.601 175.59 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.4 mpp? -88.08 112.15 22.34 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 123.562 0.745 . . . . 51.420000000000002 110.337 178.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -75.54 95.54 3.34 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 109.065 -0.717 . . . . 70.400000000000006 109.065 170.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.2 p -64.75 92.39 0.09 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.272 0.629 . . . . 41.329999999999998 110.229 -179.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -73.16 -50.52 22.15 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.693 0.797 . . . . 61.119999999999997 110.007 -173.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -101.72 96.66 7.23 Favored 'General case' 0 N--CA 1.469 0.476 0 CA-C-O 121.986 0.898 . . . . 62.240000000000002 109.575 169.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.519 HD23 ' H ' ' A' ' 16' ' ' LEU . 2.4 pt? -113.66 111.99 22.74 Favored 'General case' 0 C--O 1.242 0.7 0 N-CA-C 106.809 -1.552 . . . . 73.040000000000006 106.809 168.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.451 HG21 HD12 ' A' ' 109' ' ' LEU . 59.2 mt -90.08 138.39 19.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 115.35 -0.841 . . . . 74.430000000000007 110.313 -171.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 32.6 m170 -62.86 99.73 0.17 Allowed 'General case' 0 CA--C 1.548 0.884 0 O-C-N 124.032 0.833 . . . . 71.439999999999998 111.042 -179.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.0 mm -119.66 107.0 20.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 N-CA-C 106.044 -1.836 . . . . 70.340000000000003 106.044 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -99.36 127.57 45.4 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.392 -0.595 . . . . 71.209999999999994 109.392 -172.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 7.5 t -91.08 126.55 36.2 Favored 'General case' 0 CA--C 1.547 0.827 0 CA-C-O 121.527 0.68 . . . . 63.229999999999997 109.635 -176.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.474 HD11 HD22 ' A' ' 33' ' ' LEU . 84.3 mt -123.58 138.08 54.62 Favored 'General case' 0 C--O 1.24 0.595 0 C-N-CA 124.566 1.146 . . . . 71.109999999999999 108.834 -176.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 62.3 p -74.73 147.95 40.9 Favored 'General case' 0 CA--C 1.547 0.86 0 CA-C-N 115.539 -0.755 . . . . 74.140000000000001 110.621 178.638 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 31.7 p -117.31 162.97 25.49 Favored Pre-proline 0 CA--C 1.551 1.017 0 C-N-CA 123.977 0.911 . . . . 72.510000000000005 109.922 -176.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -64.83 -13.19 37.99 Favored 'Trans proline' 0 C--N 1.383 2.347 0 C-N-CA 122.6 2.2 . . . . 64.319999999999993 113.094 172.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -98.88 131.51 44.91 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.438 0.695 . . . . 74.430000000000007 109.208 175.393 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -67.8 -30.94 70.48 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.142 0.577 . . . . 65.319999999999993 111.164 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.405 ' HB2' ' O ' ' A' ' 88' ' ' LYS . 26.8 p-10 -95.23 2.32 54.87 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.521 0.728 . . . . 74.140000000000001 112.401 -174.443 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -111.27 156.58 21.27 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.035 0.534 . . . . 60.020000000000003 110.188 174.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 31.7 tp -149.38 120.19 7.59 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 108.813 -0.81 . . . . 64.129999999999995 108.813 175.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -82.43 117.94 22.84 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 123.849 0.86 . . . . 71.120000000000005 110.194 -178.047 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -100.26 119.34 38.24 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 107.73 -1.211 . . . . 74.010000000000005 107.73 172.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.474 HD22 HD11 ' A' ' 22' ' ' LEU . 27.3 tp -102.2 125.59 48.94 Favored 'General case' 0 C--O 1.24 0.598 0 N-CA-C 108.706 -0.85 . . . . 72.510000000000005 108.706 -172.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 34.5 m -85.61 105.87 16.5 Favored 'General case' 0 C--O 1.239 0.534 0 N-CA-C 107.206 -1.405 . . . . 61.25 107.206 175.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 41.9 p -94.05 101.11 13.13 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.533 0.733 . . . . 72.120000000000005 109.314 -178.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 37.4 t70 62.26 74.87 0.42 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 124.758 1.223 . . . . 72.310000000000002 111.033 -179.037 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -151.85 -127.94 1.37 Allowed Glycine 0 C--N 1.342 0.865 0 CA-C-N 115.033 -0.985 . . . . 64.400000000000006 111.64 -176.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.535 ' HB2' HD22 ' A' ' 109' ' ' LEU . 56.6 mm-40 -98.06 151.73 20.04 Favored 'General case' 0 N--CA 1.479 0.981 0 CA-C-N 117.718 0.759 . . . . 73.140000000000001 111.269 178.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 12.0 tpt -88.04 99.75 12.41 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 115.146 -0.934 . . . . 75.510000000000005 108.902 177.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 72.6 mt -65.04 -51.18 63.03 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.685 0.794 . . . . 44.140000000000001 111.986 -170.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.485 ' HB3' ' HA ' ' A' ' 81' ' ' ASP . 6.7 tp-100 -100.91 157.97 16.33 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 108.819 -0.808 . . . . 74.219999999999999 108.819 173.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 m -83.87 31.94 0.48 Allowed 'General case' 0 CA--C 1.567 1.631 0 C-N-CA 123.858 0.863 . . . . 72.450000000000003 112.033 -174.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 62.77 -78.19 0.03 OUTLIER 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 125.608 1.563 . . . . 71.540000000000006 111.431 177.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -79.89 64.29 3.92 Favored Glycine 0 C--N 1.355 1.586 0 N-CA-C 111.832 -0.507 . . . . 71.209999999999994 111.832 177.107 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 35.6 t -160.59 141.63 11.93 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.664 1.186 . . . . 62.32 107.984 -171.537 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 47.6 mmtm -61.2 146.22 48.46 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.398 0.679 . . . . 62.32 111.559 -178.087 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 15.5 p -69.68 97.74 1.1 Allowed 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 109.102 -0.703 . . . . 61.049999999999997 109.102 173.221 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 72.8 mt -72.44 109.49 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 CA-C-N 115.709 -0.678 . . . . 61.420000000000002 110.366 -170.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 46.5 t -85.4 106.59 15.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.624 0 N-CA-C 107.906 -1.146 . . . . 64.450000000000003 107.906 176.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.473 HG12 ' HB3' ' A' ' 57' ' ' LEU . 59.1 mt -96.33 109.65 23.24 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.349 0 N-CA-C 107.498 -1.297 . . . . 75.120000000000005 107.498 -177.054 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 96.6 mttt -92.4 160.18 15.22 Favored 'General case' 0 N--CA 1.476 0.854 0 CA-C-N 117.737 0.244 . . . . 73.430000000000007 110.385 -178.311 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 33.6 p30 -66.76 -21.59 66.05 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 122.817 0.447 . . . . 64.310000000000002 111.382 177.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 10.0 t -93.06 -23.78 18.53 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 123.861 0.864 . . . . 51.119999999999997 110.536 177.165 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -86.14 69.82 10.52 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.235 -0.654 . . . . 63.140000000000001 109.235 174.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -64.2 -24.61 67.74 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-N 114.982 -1.008 . . . . 72.349999999999994 110.831 -179.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 6.7 p-10 -59.74 -36.83 77.4 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.95 0.9 . . . . 71.109999999999999 110.835 178.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.473 ' HB3' HG12 ' A' ' 50' ' ' ILE . 88.1 mt -82.9 -28.68 29.81 Favored 'General case' 0 CA--C 1.548 0.885 0 C-N-CA 123.567 0.747 . . . . 62.130000000000003 111.517 176.026 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.472 HG22 ' HG2' ' A' ' 65' ' ' GLN . 61.7 mt -65.09 -40.14 87.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 123.45 0.7 . . . . 52.399999999999999 110.114 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 51.6 m-80 -65.97 -17.11 64.46 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.113 0.565 . . . . 63.509999999999998 112.096 175.37 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 59.5 m170 -85.79 6.57 27.42 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.169 0.588 . . . . 61.43 112.31 177.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.49 ' HB2' HD13 ' A' ' 116' ' ' ILE . 38.2 t -159.74 114.83 2.38 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.247 0.619 . . . . 75.430000000000007 110.512 179.167 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.426 ' O ' ' HG2' ' A' ' 66' ' ' GLN . 3.9 tppp? -63.16 -32.7 74.16 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 122.703 0.401 . . . . 72.450000000000003 110.844 173.641 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.451 HD11 ' HB3' ' A' ' 104' ' ' LEU . 44.8 tp -63.73 -41.18 98.09 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 122.783 0.433 . . . . 71.430000000000007 110.367 178.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -60.61 -44.57 96.16 Favored 'General case' 0 C--N 1.355 0.824 0 C-N-CA 123.16 0.584 . . . . 73.209999999999994 110.324 177.604 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.472 ' HG2' HG22 ' A' ' 58' ' ' ILE . 76.2 mt-30 -55.5 -42.93 75.12 Favored 'General case' 0 C--N 1.351 0.66 0 O-C-N 124.497 1.123 . . . . 72.439999999999998 110.973 177.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.426 ' HG2' ' O ' ' A' ' 62' ' ' LYS . 14.6 mm100 -69.73 -38.29 76.81 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.124 0.569 . . . . 73.25 112.427 -178.707 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . 0.453 HG22 HG21 ' A' ' 74' ' ' VAL . 81.8 mt -68.32 -48.16 74.5 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 122.716 0.406 . . . . 61.409999999999997 110.473 -178.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -65.19 -32.3 73.91 Favored 'General case' 0 N--CA 1.477 0.915 0 CA-C-N 115.754 -0.657 . . . . 70.25 111.391 177.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 61.5 tp -67.66 -56.38 9.58 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.236 0.614 . . . . 71.510000000000005 110.692 177.662 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 71.1 mt-30 -59.41 -34.04 71.96 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.738 0.815 . . . . 43.420000000000002 112.015 -177.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.528 ' SG ' HG23 ' A' ' 97' ' ' ILE . 63.8 m -137.05 114.89 10.02 Favored Pre-proline 0 CA--C 1.538 0.504 0 N-CA-C 110.183 -0.303 . . . . 52.439999999999998 110.183 -176.189 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 70.0 Cg_endo -71.72 -11.04 27.45 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.327 2.018 . . . . 70.430000000000007 111.849 171.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -88.04 18.65 39.01 Favored Glycine 0 C--N 1.355 1.601 0 CA-C-O 119.79 -0.45 . . . . 74.319999999999993 113.277 -177.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.631 HG22 ' NZ ' ' A' ' 88' ' ' LYS . 15.1 t -97.54 124.79 50.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 108.794 -0.817 . . . . 75.430000000000007 108.794 172.26 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -84.2 -52.21 6.43 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.656 0.382 . . . . 61.409999999999997 110.297 176.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 97.1 p -156.18 172.31 18.67 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 112.057 0.391 . . . . 62.409999999999997 112.057 -177.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 34.5 mt -131.47 126.03 33.98 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 108.226 -1.027 . . . . 74.299999999999997 108.226 178.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.486 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.3 ttm -100.92 111.56 23.8 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 108.775 -0.824 . . . . 73.430000000000007 108.775 178.716 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.616 HD13 HD13 ' A' ' 84' ' ' LEU . 20.9 mm -86.16 98.05 6.48 Favored 'Isoleucine or valine' 0 C--N 1.349 0.564 0 N-CA-C 108.82 -0.807 . . . . 71.340000000000003 108.82 -177.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -90.06 176.27 42.15 Favored Glycine 0 C--O 1.243 0.715 0 N-CA-C 111.174 -0.77 . . . . 50.399999999999999 111.174 176.019 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.485 ' HA ' ' HB3' ' A' ' 41' ' ' GLN . 31.1 m-20 -51.48 -59.74 3.92 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 124.265 1.026 . . . . 74.099999999999994 111.611 -176.216 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.8 p-10 -128.5 22.46 5.97 Favored 'General case' 0 C--N 1.321 -0.659 0 CA-C-N 114.153 -1.385 . . . . 74.439999999999998 110.016 -174.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . 0.441 ' HB3' HD12 ' A' ' 33' ' ' LEU . 37.0 p90 -149.12 154.94 39.95 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 122.895 0.478 . . . . 74.540000000000006 110.789 -175.162 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.616 HD13 HD13 ' A' ' 79' ' ' ILE . 27.5 tp -131.34 110.95 11.44 Favored 'General case' 0 N--CA 1.466 0.328 0 N-CA-C 108.082 -1.081 . . . . 70.129999999999995 108.082 176.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.486 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 41.7 m -100.01 109.73 22.05 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 108.48 -0.934 . . . . 51.420000000000002 108.48 -176.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.547 HG13 HD13 ' A' ' 101' ' ' ILE . 20.9 mm -86.38 131.71 34.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 N-CA-C 108.012 -1.107 . . . . 72.019999999999996 108.012 -175.362 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 31.0 m-80 -112.0 124.44 52.4 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 108.017 -1.105 . . . . 71.219999999999999 108.017 178.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.631 ' NZ ' HG22 ' A' ' 74' ' ' VAL . 69.1 mttm -129.12 177.39 7.18 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 124.318 1.047 . . . . 73.549999999999997 109.475 -178.307 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -63.11 139.37 58.76 Favored 'General case' 0 CA--C 1.543 0.709 0 O-C-N 123.49 0.494 . . . . 72.299999999999997 109.956 168.597 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 4.2 ptm180 -62.1 -27.52 68.98 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.661 0.784 . . . . 61.420000000000002 112.571 -174.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 26.4 mmt -87.38 -16.72 34.14 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.584 0.354 . . . . 74.010000000000005 111.659 -178.111 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 72.6 t -75.57 133.76 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.395 -0.965 . . . . 63.049999999999997 108.395 173.049 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 65.5 m170 -104.53 148.88 25.99 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.25 0.548 . . . . 72.140000000000001 110.33 -176.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 86.1 m95 -76.94 -19.13 57.74 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 124.134 0.974 . . . . 75.239999999999995 112.262 -173.278 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -57.7 -26.95 62.45 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 122.901 0.48 . . . . 74.549999999999997 111.667 -177.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 48.8 m -82.81 -52.49 6.69 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 122.961 0.505 . . . . 75.439999999999998 111.989 177.215 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.528 HG23 ' SG ' ' A' ' 71' ' ' CYS . 26.8 mt -93.94 -33.46 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.518 0 N-CA-C 113.133 0.79 . . . . 55.409999999999997 113.133 -164.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 33.5 ttpt -49.43 -46.74 78.16 Favored Pre-proline 0 CA--C 1.568 1.667 0 CA-C-O 117.564 -1.207 . . . . 70.019999999999996 113.784 -178.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 19.1 Cg_endo -56.0 -35.59 94.76 Favored 'Trans proline' 0 C--N 1.396 3.029 0 CA-C-N 121.626 1.616 . . . . 60.420000000000002 112.844 174.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 9.9 mm-40 -73.16 -34.83 66.27 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.207 0.603 . . . . 51.509999999999998 110.595 -179.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.547 HD13 HG13 ' A' ' 86' ' ' ILE . 84.0 mt -68.5 -49.06 69.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.794 0 C-N-CA 123.481 0.712 . . . . 75.319999999999993 109.921 178.408 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 87.1 mt -58.23 -38.07 66.38 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 123.594 0.758 . . . . 74.200000000000003 110.301 177.306 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . 0.401 ' O ' ' HG2' ' A' ' 107' ' ' LYS . 13.6 t70 -61.98 -51.53 67.69 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.829 0.852 . . . . 73.420000000000002 110.923 176.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.451 ' HB3' HD11 ' A' ' 63' ' ' LEU . 69.7 mt -62.9 -39.38 94.33 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 124.09 0.956 . . . . 55.229999999999997 111.92 -179.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.491 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 8.5 mp -70.42 -28.55 65.14 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 123.398 0.679 . . . . 62.43 110.5 178.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 94.8 m -69.58 -37.06 76.82 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 109.111 -0.699 . . . . 74.109999999999999 109.111 174.743 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.401 ' HG2' ' O ' ' A' ' 103' ' ' ASP . 45.3 mmtm -67.9 -44.95 75.76 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.053 0.541 . . . . 72.129999999999995 110.328 178.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 25.6 tp60 -58.23 -47.23 84.18 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 124.447 1.099 . . . . 75.549999999999997 111.017 -178.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.535 HD22 ' HB2' ' A' ' 38' ' ' GLU . 18.0 mt -76.4 -26.55 55.7 Favored 'General case' 0 CA--C 1.553 1.08 0 CA-C-N 115.821 -0.627 . . . . 73.299999999999997 110.708 179.832 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.26 -21.88 60.52 Favored 'General case' 0 N--CA 1.491 1.595 0 C-N-CA 123.042 0.537 . . . . 74.109999999999999 111.69 178.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -69.4 -24.81 63.9 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 110.133 -0.321 . . . . 44.329999999999998 110.133 170.357 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 71.76 38.52 60.82 Favored Glycine 0 C--N 1.347 1.161 0 N-CA-C 111.079 -0.808 . . . . 63.119999999999997 111.079 -174.395 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -135.59 160.4 38.62 Favored 'General case' 0 C--N 1.355 0.812 0 C-N-CA 124.11 0.964 . . . . 71.310000000000002 111.643 -173.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -78.93 152.59 31.01 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 114.404 -1.271 . . . . 63.240000000000002 109.293 177.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.599 HG13 HG12 ' A' ' 116' ' ' ILE . 7.8 p -76.44 -36.91 29.73 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.253 0 C-N-CA 122.839 0.456 . . . . 73.540000000000006 110.535 178.489 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.599 HG12 HG13 ' A' ' 115' ' ' VAL . 43.7 mm -114.83 151.12 16.61 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 124.356 1.062 . . . . 74.319999999999993 108.937 178.007 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 37.5 t -88.99 172.99 8.72 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.029 0.532 . . . . 72.319999999999993 110.092 175.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.61 -16.81 60.78 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.269 0.628 . . . . 74.140000000000001 110.696 173.691 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 . . . . . 0 C--O 1.253 1.275 0 C-N-CA 124.45 1.1 . . . . 72.109999999999999 110.535 -178.485 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.1 mpt? . . . . . 0 N--CA 1.484 1.239 0 N-CA-C 109.707 -0.479 . . . . 55.039999999999999 109.707 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -135.95 45.96 1.06 Allowed Glycine 0 C--N 1.348 1.212 0 O-C-N 123.344 0.402 . . . . 71.140000000000001 112.151 -177.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 59.0 t-80 -156.38 154.68 30.9 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.29 1.036 . . . . 75.120000000000005 108.238 178.472 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 26.8 p80 -149.73 169.21 21.58 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.329 0.651 . . . . 74.219999999999999 109.629 179.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 28.4 p-80 -150.95 136.51 17.9 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.659 0.384 . . . . 74.040000000000006 110.53 -179.002 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 25.0 m170 -116.29 169.98 8.88 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.167 0.987 . . . . 53.509999999999998 109.329 173.076 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.6 p80 -135.97 103.22 5.29 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.831 0.852 . . . . 71.400000000000006 110.081 -175.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 38.1 m-70 -103.65 104.05 14.04 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.627 0.771 . . . . 70.329999999999998 109.439 177.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.6 t -90.23 61.99 5.29 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 108.548 -0.908 . . . . 64.530000000000001 108.548 173.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 59.9 t-80 -76.98 94.65 4.0 Favored 'General case' 0 C--N 1.351 0.646 0 CA-C-N 115.302 -0.863 . . . . 62.450000000000003 109.814 -176.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ttt -72.39 91.84 1.39 Allowed 'General case' 0 CA--C 1.546 0.795 0 CA-C-N 115.573 -0.74 . . . . 71.340000000000003 110.212 177.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 24.3 p-10 -93.79 148.91 21.69 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 108.808 -0.812 . . . . 51.119999999999997 108.808 171.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 36.4 t -143.36 109.85 5.44 Favored 'General case' 0 CA--C 1.537 0.45 0 N-CA-C 109.483 -0.562 . . . . 73.400000000000006 109.483 -177.529 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -145.37 150.13 36.02 Favored 'General case' 0 C--O 1.241 0.651 0 C-N-CA 124.356 1.063 . . . . 72.420000000000002 108.218 175.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -85.67 106.18 16.76 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 109.769 -0.456 . . . . 75.129999999999995 109.769 -175.765 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.6 mp -76.38 91.24 3.26 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.195 -0.669 . . . . 74.239999999999995 109.195 174.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.572 ' H ' HG23 ' A' ' 106' ' ' THR . 64.5 mt -59.51 110.44 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 114.58 -1.191 . . . . 71.230000000000004 109.304 174.583 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 81.2 m-70 -71.89 136.18 46.82 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-N 115.521 -0.763 . . . . 74.510000000000005 109.229 -176.747 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 48.9 mm -118.55 143.32 29.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.899 0 N-CA-C 107.9 -1.148 . . . . 64.329999999999998 107.9 179.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.46 ' HD2' HD23 ' A' ' 33' ' ' LEU . 40.4 ttmt -91.49 114.97 27.64 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 109.421 -0.585 . . . . 64.219999999999999 109.421 -177.516 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 97.6 m -95.05 120.88 36.01 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 108.93 -0.767 . . . . 74.540000000000006 108.93 -179.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 96.6 mt -125.23 141.91 51.81 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 124.333 1.053 . . . . 72.430000000000007 109.536 -174.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 27.6 p -73.97 143.37 45.67 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.143 0.577 . . . . 72.239999999999995 110.44 174.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 67.3 p -111.95 160.89 28.19 Favored Pre-proline 0 N--CA 1.478 0.947 0 C-N-CA 124.245 1.018 . . . . 72.209999999999994 109.401 -178.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 90.7 Cg_endo -79.29 30.85 0.47 Allowed 'Trans proline' 0 C--N 1.375 1.95 0 C-N-CA 123.192 2.595 . . . . 71.140000000000001 112.855 172.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.0 t-20 -142.28 127.43 18.57 Favored 'General case' 0 C--O 1.24 0.581 0 N-CA-C 108.398 -0.964 . . . . 64.439999999999998 108.398 -177.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -73.2 158.22 35.66 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.382 -0.599 . . . . 63.119999999999997 109.382 173.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.0 m-20 70.49 -6.46 1.19 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.113 1.365 . . . . 72.319999999999993 111.68 -173.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.42 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -117.57 145.51 44.23 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 124.101 0.961 . . . . 63.5 109.758 -172.598 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 41.6 tp -153.2 129.69 10.67 Favored 'General case' 0 N--CA 1.475 0.817 0 N-CA-C 108.864 -0.791 . . . . 75.540000000000006 108.864 179.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -82.82 131.53 35.19 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 123.754 0.821 . . . . 63.5 111.127 -175.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 93.1 m-85 -122.19 114.37 20.76 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 106.977 -1.49 . . . . 73.209999999999994 106.977 172.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.46 HD23 ' HD2' ' A' ' 20' ' ' LYS . 52.7 tp -113.86 127.92 56.19 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 123.983 0.913 . . . . 61.219999999999999 110.269 -165.782 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 23.1 m -90.29 103.73 16.38 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.156 -1.053 . . . . 63.32 108.156 177.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 73.5 p -102.34 -11.45 18.66 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 123.966 0.907 . . . . 64.120000000000005 111.578 -178.537 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -62.88 -44.93 94.79 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.943 0.897 . . . . 73.430000000000007 111.875 -177.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 150.83 -32.4 0.98 Allowed Glycine 0 C--N 1.346 1.108 0 CA-C-N 116.277 -0.42 . . . . 53.32 113.184 178.852 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -69.98 106.66 3.28 Favored 'General case' 0 N--CA 1.474 0.768 0 CA-C-O 121.036 0.446 . . . . 51.030000000000001 109.829 -179.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 9.5 tpt -85.2 133.97 34.17 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.319 1.048 . . . . 62.420000000000002 109.865 -171.606 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.415 ' O ' HG12 ' A' ' 115' ' ' VAL . 73.5 mt -70.46 -35.59 73.41 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.473 0.709 . . . . 73.409999999999997 112.756 -172.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 48.6 mt-30 -141.53 165.6 27.05 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 107.874 -1.158 . . . . 72.200000000000003 107.874 172.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 29.9 m -60.57 121.63 12.66 Favored 'General case' 0 CA--C 1.548 0.881 0 O-C-N 123.355 0.409 . . . . 61.119999999999997 110.063 178.289 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 57.5 ttp180 -54.92 118.07 3.97 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.259 1.024 . . . . 72.140000000000001 111.674 -168.144 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 112.57 11.45 14.9 Favored Glycine 0 C--N 1.34 0.772 0 CA-C-N 115.342 -0.845 . . . . 75.129999999999995 111.962 -170.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.57 ' HB3' ' HB3' ' A' ' 81' ' ' ASP . 35.1 t -84.8 156.75 21.22 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.647 0.779 . . . . 73.109999999999999 110.908 179.629 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 14.2 mmmm -81.22 154.28 26.73 Favored 'General case' 0 C--O 1.246 0.892 0 C-N-CA 123.932 0.893 . . . . 72.439999999999998 110.116 -178.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 46.0 p -79.39 91.47 5.09 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.902 0.481 . . . . 72.230000000000004 109.825 176.345 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 58.3 mt -75.77 116.69 19.08 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 C-N-CA 124.018 0.927 . . . . 75.310000000000002 109.866 -176.904 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 87.5 t -90.88 119.28 37.74 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 108.579 -0.897 . . . . 72.340000000000003 108.579 178.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.411 HG23 ' HB2' ' A' ' 57' ' ' LEU . 61.3 mt -117.11 110.65 31.97 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 107.775 -1.194 . . . . 70.150000000000006 107.775 -179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.402 ' HG2' ' HB2' ' A' ' 76' ' ' SER . 10.2 mtmp? -93.29 172.58 8.2 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 109.595 -0.52 . . . . 74.150000000000006 109.595 177.643 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 30.9 p30 -64.7 -21.15 66.68 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.212 0.605 . . . . 70.150000000000006 112.345 -177.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 12.5 t -83.92 -21.18 31.95 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 122.507 0.323 . . . . 74.230000000000004 110.717 176.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -83.23 56.33 3.49 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.999 0.92 . . . . 73.420000000000002 110.296 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.425 ' HA ' HD12 ' A' ' 58' ' ' ILE . 34.5 tt0 -63.73 -25.72 68.32 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.457 0.703 . . . . 63.219999999999999 111.667 -175.096 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -62.18 -45.51 93.08 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 123.79 0.836 . . . . 72.319999999999993 110.281 173.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.45 ' HA ' ' HD2' ' A' ' 60' ' ' HIS . 87.0 mt -73.29 -30.03 63.13 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 115.703 -0.681 . . . . 71.219999999999999 111.106 179.353 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.425 HD12 ' HA ' ' A' ' 55' ' ' GLU . 75.5 mt -65.28 -39.06 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 C-N-CA 123.203 0.601 . . . . 73.030000000000001 109.427 175.006 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -70.68 -10.85 60.34 Favored 'General case' 0 N--CA 1.484 1.268 0 N-CA-C 112.965 0.728 . . . . 73.040000000000006 112.965 178.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.45 ' HD2' ' HA ' ' A' ' 57' ' ' LEU . 83.2 m-70 -80.79 -34.3 34.19 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 122.701 0.4 . . . . 54.0 110.619 170.561 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.487 ' HB2' HD13 ' A' ' 116' ' ' ILE . 39.3 t -108.65 106.78 16.98 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 123.326 0.65 . . . . 61.43 110.611 -177.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -54.77 -37.51 66.09 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.392 0.677 . . . . 72.150000000000006 110.809 173.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 41.8 tp -63.13 -42.55 99.52 Favored 'General case' 0 C--N 1.35 0.594 0 C-N-CA 123.537 0.735 . . . . 73.549999999999997 111.033 178.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -59.79 -45.08 93.41 Favored 'General case' 0 C--N 1.354 0.784 0 C-N-CA 122.819 0.448 . . . . 72.409999999999997 109.833 178.638 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -55.95 -44.38 78.37 Favored 'General case' 0 C--N 1.353 0.734 0 O-C-N 124.065 0.853 . . . . 74.129999999999995 110.812 177.382 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 23.5 mm-40 -62.36 -46.56 88.09 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.69 0.796 . . . . 73.299999999999997 112.069 178.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 90.9 mt -64.71 -49.83 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.25 0 C-N-CA 123.641 0.776 . . . . 61.439999999999998 111.065 -175.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 68.5 m-85 -66.76 -36.19 81.85 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 123.417 0.687 . . . . 64.430000000000007 111.502 179.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 55.9 tp -64.99 -46.6 80.76 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.444 0.698 . . . . 73.329999999999998 110.835 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.493 ' NE2' HD21 ' A' ' 104' ' ' LEU . 75.3 mt-30 -73.21 -28.92 62.45 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-N 115.123 -0.944 . . . . 63.299999999999997 111.642 -178.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.439 ' SG ' HD13 ' A' ' 97' ' ' ILE . 42.9 t -149.08 104.16 3.36 Favored Pre-proline 0 CA--C 1.542 0.672 0 C-N-CA 122.47 0.308 . . . . 64.120000000000005 110.783 -179.173 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -78.08 14.55 1.51 Allowed 'Trans proline' 0 C--N 1.373 1.816 0 C-N-CA 122.738 2.292 . . . . 43.450000000000003 112.745 171.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -85.77 -18.42 59.9 Favored Glycine 0 C--N 1.35 1.322 0 N-CA-C 111.764 -0.535 . . . . 75.030000000000001 111.764 170.184 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.424 ' HA ' ' HB3' ' A' ' 88' ' ' LYS . 87.7 t -70.74 114.59 8.89 Favored 'Isoleucine or valine' 0 C--N 1.351 0.669 0 N-CA-C 109.228 -0.656 . . . . 70.239999999999995 109.228 175.402 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 -86.02 -32.95 21.19 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.264 0.626 . . . . 72.510000000000005 110.678 -174.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . 0.402 ' HB2' ' HG2' ' A' ' 51' ' ' LYS . 33.4 t -161.45 167.14 26.13 Favored 'General case' 0 C--N 1.349 0.566 0 CA-C-O 121.345 0.593 . . . . 54.0 111.319 -175.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 76.7 mt -134.4 128.61 33.92 Favored 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 124.721 1.208 . . . . 71.0 107.928 173.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.48 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 54.1 ttm -96.21 108.18 20.61 Favored 'General case' 0 C--O 1.242 0.707 0 N-CA-C 107.371 -1.344 . . . . 71.120000000000005 107.371 168.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . . . . . . . . . 20.1 mm -91.33 105.38 16.45 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 123.437 0.695 . . . . 71.400000000000006 109.146 -174.562 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.87 163.29 24.5 Favored Glycine 0 C--O 1.242 0.636 0 N-CA-C 109.657 -1.377 . . . . 61.520000000000003 109.657 173.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.57 ' HB3' ' HB3' ' A' ' 45' ' ' SER . 19.3 p-10 -74.08 -34.92 64.18 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 122.885 0.474 . . . . 71.319999999999993 110.595 175.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -99.55 -32.86 10.89 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 123.933 0.893 . . . . 73.040000000000006 111.259 -178.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 29.2 p90 -131.28 169.28 16.19 Favored 'General case' 0 N--CA 1.484 1.237 0 C-N-CA 123.276 0.63 . . . . 73.549999999999997 111.739 -170.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 54.2 tp -141.12 109.94 6.08 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 123.625 0.77 . . . . 63.350000000000001 109.619 178.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.48 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 59.8 m -100.79 111.57 23.82 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.713 -0.847 . . . . 41.039999999999999 108.713 -178.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.532 HG13 HD13 ' A' ' 101' ' ' ILE . 27.2 mm -86.99 126.22 40.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.487 -0.931 . . . . 55.450000000000003 108.487 -176.753 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -108.52 124.63 50.75 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 108.355 -0.98 . . . . 55.219999999999999 108.355 176.61 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.424 ' HB3' ' HA ' ' A' ' 74' ' ' VAL . 0.6 OUTLIER -150.2 152.96 35.45 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.228 1.011 . . . . 71.439999999999998 109.154 -177.042 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -60.57 132.32 53.54 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.203 0.601 . . . . 65.219999999999999 110.427 -172.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 10.7 ptm180 -62.39 -23.4 66.81 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.633 1.173 . . . . 74.120000000000005 112.493 -175.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.2 mmt -66.21 -30.86 71.39 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.865 0.466 . . . . 75.450000000000003 110.679 -179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 24.6 t -92.98 142.83 12.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 N-CA-C 107.151 -1.426 . . . . 64.129999999999995 107.151 172.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 69.2 m80 -102.72 156.82 17.38 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 121.34 0.59 . . . . 64.310000000000002 111.579 -176.204 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 92.7 m95 -69.02 -17.84 63.96 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-N 114.629 -1.169 . . . . 54.140000000000001 111.795 179.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 1.8 m-20 -56.01 -31.08 62.75 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.756 0.822 . . . . 74.430000000000007 111.806 -177.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 36.9 m -92.08 -36.17 13.5 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.382 0.673 . . . . 64.109999999999999 112.034 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.439 HD13 ' SG ' ' A' ' 71' ' ' CYS . 30.4 mt -97.74 -43.15 11.99 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 N-CA-C 112.305 0.483 . . . . 71.299999999999997 112.305 -164.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 29.1 ttpp -51.78 -46.15 91.86 Favored Pre-proline 0 N--CA 1.492 1.634 0 CA-C-O 117.76 -1.114 . . . . 73.400000000000006 113.68 -177.022 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 12.1 Cg_endo -53.83 -41.88 70.98 Favored 'Trans proline' 0 C--N 1.402 3.361 0 C-N-CA 121.839 1.693 . . . . 73.140000000000001 112.337 173.02 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 -67.66 -39.48 84.56 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 115.345 -0.843 . . . . 70.349999999999994 110.486 -178.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.532 HD13 HG13 ' A' ' 86' ' ' ILE . 93.7 mt -62.89 -51.54 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 123.572 0.749 . . . . 72.450000000000003 110.395 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 83.7 mt -59.8 -38.28 75.37 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 O-C-N 123.748 0.655 . . . . 65.010000000000005 110.682 -178.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -67.94 -39.31 83.46 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 124.018 0.927 . . . . 61.030000000000001 111.278 179.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.493 HD21 ' NE2' ' A' ' 70' ' ' GLN . 77.7 mt -65.72 -39.99 91.75 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.565 0.746 . . . . 73.109999999999999 111.799 174.058 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.433 ' O ' ' HG ' ' A' ' 109' ' ' LEU . 10.8 mp -68.99 -25.0 64.3 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.032 0.533 . . . . 75.019999999999996 110.36 176.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.572 HG23 ' H ' ' A' ' 17' ' ' ILE . 88.6 m -71.61 -50.91 26.4 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 122.984 0.514 . . . . 73.310000000000002 110.038 176.748 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -65.67 -36.47 83.75 Favored 'General case' 0 N--CA 1.481 1.099 0 O-C-N 123.386 0.429 . . . . 73.519999999999996 110.879 -176.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 28.0 tt0 -59.41 -56.33 23.37 Favored 'General case' 0 C--N 1.355 0.837 0 C-N-CA 122.72 0.408 . . . . 55.329999999999998 110.62 177.613 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.433 ' HG ' ' O ' ' A' ' 105' ' ' LEU . 50.2 mt -69.65 -22.47 63.45 Favored 'General case' 0 CA--C 1.547 0.838 0 O-C-N 123.792 0.683 . . . . 74.420000000000002 111.333 -176.653 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.67 -35.84 70.43 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.567 0.747 . . . . 72.230000000000004 111.888 -179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 15.7 m-85 -108.26 -13.47 14.89 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 122.952 0.501 . . . . 74.109999999999999 111.474 -178.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -148.7 -159.12 8.35 Favored Glycine 0 C--N 1.345 1.063 0 N-CA-C 112.082 -0.407 . . . . 62.219999999999999 112.082 -175.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -131.85 -60.17 0.93 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.754 0.822 . . . . 72.109999999999999 109.106 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -79.87 171.38 15.19 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 114.31 -1.314 . . . . 51.200000000000003 111.98 -174.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.476 HG13 HG12 ' A' ' 116' ' ' ILE . 5.4 p -110.95 -37.75 3.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 CA-C-N 114.085 -1.416 . . . . 74.310000000000002 109.874 -179.52 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.487 HD13 ' HB2' ' A' ' 61' ' ' SER . 41.9 mm -92.06 -80.51 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 122.743 0.417 . . . . 75.420000000000002 109.882 -178.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 49.7 m -152.3 156.36 39.48 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 122.871 0.469 . . . . 70.120000000000005 111.153 -171.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . 0.412 ' HD3' ' H ' ' A' ' 118' ' ' LYS . 0.4 OUTLIER -125.32 31.16 5.63 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.379 1.072 . . . . 75.230000000000004 108.86 173.263 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 . . . . . 0 C--O 1.251 1.137 0 C-N-CA 124.105 0.962 . . . . 61.399999999999999 109.04 179.693 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mpp? . . . . . 0 N--CA 1.479 0.993 0 N-CA-C 109.314 -0.625 . . . . 70.340000000000003 109.314 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 130.29 122.17 2.39 Favored Glycine 0 C--N 1.34 0.79 0 N-CA-C 110.747 -0.941 . . . . 62.539999999999999 110.747 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 39.4 p-80 -149.91 112.14 4.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.341 0.656 . . . . 73.129999999999995 109.509 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 13.0 p80 -162.27 108.65 1.27 Allowed 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.746 0.818 . . . . 72.430000000000007 109.406 178.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.6 p80 -156.36 41.02 0.36 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 124.201 1.001 . . . . 70.340000000000003 109.473 -177.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -66.57 147.72 52.89 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.81 0.844 . . . . 75.299999999999997 111.478 -177.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 50.6 m-70 -111.35 143.07 42.75 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 123.901 0.88 . . . . 53.039999999999999 110.259 -179.042 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 8.1 p80 -175.01 121.53 0.22 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.125 0.97 . . . . 64.329999999999998 108.998 168.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 63.1 m -141.99 114.94 8.68 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.272 0.629 . . . . 72.200000000000003 110.833 -177.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 89.0 m-70 -90.14 139.55 30.52 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.587 0.755 . . . . 75.140000000000001 109.504 174.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.1 ptp -149.8 104.78 3.35 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-O 121.209 0.528 . . . . 64.409999999999997 110.366 -176.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -159.24 111.0 2.11 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 108.939 -0.763 . . . . 72.530000000000001 108.939 178.429 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 24.8 t -92.08 7.46 42.28 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.701 0.8 . . . . 62.549999999999997 111.156 178.423 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -89.69 157.69 17.88 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.775 0.83 . . . . 63.229999999999997 110.001 176.034 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -148.51 134.76 19.39 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 108.553 -0.906 . . . . 74.120000000000005 108.553 170.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -116.68 162.79 17.11 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.007 0.523 . . . . 63.350000000000001 110.296 -178.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.458 ' HB ' ' HA ' ' A' ' 106' ' ' THR . 69.0 mt -79.26 117.86 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 123.608 0.763 . . . . 71.239999999999995 110.78 -177.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 69.1 m80 -83.1 131.13 35.16 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 124.568 1.147 . . . . 75.5 110.47 -175.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . 0.403 ' HB ' HG23 ' A' ' 102' ' ' ILE . 47.9 mm -130.17 121.32 51.3 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 N-CA-C 108.059 -1.089 . . . . 74.219999999999999 108.059 -175.313 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 24.4 ttmm -90.77 143.34 26.83 Favored 'General case' 0 N--CA 1.469 0.508 0 C-N-CA 124.732 1.213 . . . . 75.230000000000004 110.021 -179.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 47.1 m -101.83 120.28 40.12 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 123.43 0.692 . . . . 73.109999999999999 109.727 175.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 95.8 mt -125.16 138.17 54.15 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.133 0.973 . . . . 72.329999999999998 109.633 -179.825 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 70.5 p -86.66 144.46 27.13 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.06 0.544 . . . . 74.209999999999994 110.615 178.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.4 p -108.34 172.78 3.44 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 124.875 1.27 . . . . 75.239999999999995 108.469 177.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -75.57 50.56 2.72 Favored 'Trans proline' 0 C--N 1.376 2.001 0 C-N-CA 122.13 1.887 . . . . 74.219999999999999 112.372 168.688 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 47.9 t-20 -162.27 141.14 9.21 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 124.344 1.058 . . . . 73.540000000000006 108.504 -176.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -94.29 -31.94 13.86 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.137 0.575 . . . . 62.439999999999998 110.593 -177.899 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 94.1 m-20 -89.78 7.49 36.65 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.916 0.886 . . . . 74.150000000000006 111.798 179.159 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.466 ' HA ' ' O ' ' A' ' 86' ' ' ILE . . . -136.53 126.17 25.4 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 123.796 0.838 . . . . 63.219999999999999 109.052 174.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 56.1 tp -128.42 134.24 48.74 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 123.461 0.704 . . . . 63.509999999999998 109.177 179.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -90.87 129.74 36.89 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 124.479 1.111 . . . . 54.329999999999998 110.538 -176.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -114.7 116.41 28.65 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.717 -1.216 . . . . 75.340000000000003 107.717 171.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.4 tp -100.06 127.32 46.31 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 107.451 -1.314 . . . . 75.019999999999996 107.451 -177.438 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 43.2 t -72.39 107.33 4.91 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 107.254 -1.388 . . . . 73.25 107.254 171.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 8.9 t -105.64 18.97 21.33 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.474 0.654 . . . . 75.019999999999996 109.73 -179.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -91.32 -55.5 3.49 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.368 0.667 . . . . 64.340000000000003 109.888 177.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 156.65 -17.13 0.41 Allowed Glycine 0 C--N 1.344 1.024 0 CA-C-N 115.908 -0.587 . . . . 31.530000000000001 113.171 -175.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.0 mm-40 -84.92 105.76 15.93 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.24 0.616 . . . . 62.109999999999999 111.229 -176.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 40.2 ttm -74.97 132.91 41.73 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 109.502 -0.555 . . . . 75.109999999999999 109.502 175.212 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 57.3 mt -62.64 -48.72 78.12 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.826 0.704 . . . . 73.049999999999997 111.342 -177.239 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -132.5 -84.77 0.48 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 116.182 -0.463 . . . . 73.439999999999998 109.843 -179.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 94.9 m -162.33 146.2 11.91 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.958 0.903 . . . . 71.319999999999993 108.578 -174.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 6.0 ppt_? -72.6 144.05 48.0 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 122.622 0.369 . . . . 73.219999999999999 111.447 173.415 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 80.49 21.8 63.64 Favored Glycine 0 C--N 1.348 1.216 0 CA-C-N 115.754 -0.657 . . . . 71.409999999999997 113.13 -178.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 50.3 m -91.97 159.79 15.57 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 123.191 0.597 . . . . 71.049999999999997 110.79 179.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 54.8 mttp -97.3 126.6 42.63 Favored 'General case' 0 N--CA 1.47 0.571 0 N-CA-C 107.755 -1.202 . . . . 73.019999999999996 107.755 170.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 49.8 m -59.56 121.53 11.8 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.853 0.861 . . . . 75.510000000000005 112.995 -169.489 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 61.4 mt -87.34 130.89 36.43 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 C-N-CA 124.011 0.925 . . . . 72.510000000000005 110.085 -178.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 57.5 t -97.46 108.64 21.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.705 0 N-CA-C 109.263 -0.643 . . . . 75.349999999999994 109.263 178.646 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 72.1 mt -90.38 110.04 21.54 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.549 1.14 . . . . 75.329999999999998 107.961 175.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 81.5 mttt -84.24 144.36 28.98 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.544 0.738 . . . . 72.430000000000007 110.205 -174.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.4 ' HA ' HD11 ' A' ' 58' ' ' ILE . 31.8 p-10 -65.79 -29.27 69.73 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.086 0.554 . . . . 72.150000000000006 111.321 175.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.2 t -82.15 -14.38 55.76 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.818 0.847 . . . . 64.140000000000001 111.208 178.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -102.61 82.46 2.15 Favored 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.232 -1.025 . . . . 74.140000000000001 108.232 -179.686 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.415 ' HA ' HD12 ' A' ' 58' ' ' ILE . 0.1 OUTLIER -57.5 -25.05 59.21 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.117 0.967 . . . . 75.040000000000006 112.519 -178.298 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -65.39 -52.68 51.8 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.201 0.601 . . . . 74.340000000000003 110.992 179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.6 mt -60.45 -36.18 77.61 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 122.951 0.5 . . . . 73.030000000000001 110.39 179.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.415 HD12 ' HA ' ' A' ' 55' ' ' GLU . 68.8 mt -64.46 -47.12 90.69 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.716 0 CA-C-N 115.023 -0.99 . . . . 72.219999999999999 110.522 177.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.433 ' HA ' ' NE2' ' A' ' 65' ' ' GLN . 91.2 m-20 -62.12 -32.19 72.73 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.334 0.654 . . . . 75.340000000000003 112.42 -178.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -80.08 -6.47 57.73 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.018 0.527 . . . . 75.310000000000002 112.047 -179.502 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.419 ' HB3' HG12 ' A' ' 116' ' ' ILE . 23.4 p -131.65 104.46 6.94 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.426 0.691 . . . . 52.32 109.558 -179.79 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.9 tptm -52.21 -38.28 57.47 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.146 0.978 . . . . 72.340000000000003 112.285 -178.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.5 HD11 HD12 ' A' ' 105' ' ' LEU . 22.7 tp -61.89 -42.29 98.9 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 123.975 0.797 . . . . 73.200000000000003 111.769 179.098 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -63.47 -44.12 95.37 Favored 'General case' 0 C--N 1.351 0.669 0 O-C-N 123.66 0.6 . . . . 74.319999999999993 110.804 -177.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.433 ' NE2' ' HA ' ' A' ' 59' ' ' ASN . 98.6 mt-30 -54.86 -48.04 73.43 Favored 'General case' 0 C--N 1.348 0.525 0 O-C-N 124.122 0.889 . . . . 74.540000000000006 110.643 176.579 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -63.48 -44.62 93.87 Favored 'General case' 0 CA--C 1.552 1.028 0 O-C-N 123.87 0.731 . . . . 71.319999999999993 112.84 179.213 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 63.5 mt -65.77 -49.68 75.77 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.191 0 C-N-CA 123.328 0.651 . . . . 53.530000000000001 110.868 -176.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -69.93 -30.0 67.29 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.656 0.382 . . . . 74.439999999999998 111.809 -178.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 67.1 tp -64.11 -48.72 75.01 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.59 0.756 . . . . 72.409999999999997 110.693 175.771 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -86.78 -16.88 34.93 Favored 'General case' 0 N--CA 1.469 0.483 0 CA-C-N 115.068 -0.969 . . . . 71.219999999999999 111.943 -173.512 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 54.0 t -149.44 104.62 3.29 Favored Pre-proline 0 CA--C 1.545 0.774 0 C-N-CA 122.928 0.491 . . . . 73.120000000000005 110.383 177.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 95.7 Cg_endo -78.94 5.72 5.49 Favored 'Trans proline' 0 C--N 1.377 2.041 0 C-N-CA 122.671 2.247 . . . . 63.409999999999997 112.765 172.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.23 -26.68 67.76 Favored Glycine 0 C--N 1.354 1.539 0 N-CA-C 112.262 -0.335 . . . . 44.210000000000001 112.262 176.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.402 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 40.7 t -75.36 127.73 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.927 0 C-N-CA 123.056 0.542 . . . . 60.329999999999998 110.368 -176.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.3 mt-10 -89.06 -36.43 15.78 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.282 1.033 . . . . 53.200000000000003 111.026 -177.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 67.1 p -164.63 162.02 21.24 Favored 'General case' 0 N--CA 1.474 0.741 0 CA-C-O 121.339 0.59 . . . . 62.509999999999998 111.633 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 64.9 mt -118.72 131.14 56.13 Favored 'General case' 0 N--CA 1.465 0.278 0 C-N-CA 124.609 1.163 . . . . 62.539999999999999 108.168 176.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.514 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 43.0 ttm -105.21 103.85 13.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 108.407 -0.96 . . . . 54.329999999999998 108.407 175.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.478 HD13 HD13 ' A' ' 84' ' ' LEU . 49.3 mm -82.38 106.92 13.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 124.447 1.099 . . . . 75.129999999999995 108.773 -177.024 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -87.54 -163.9 39.55 Favored Glycine 0 C--O 1.246 0.863 0 O-C-N 123.688 0.617 . . . . 74.239999999999995 111.876 174.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 59.2 m-20 -64.24 -66.16 0.58 Allowed 'General case' 0 C--O 1.24 0.598 0 CA-C-O 121.61 0.719 . . . . 65.340000000000003 110.036 177.056 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -127.89 10.57 6.51 Favored 'General case' 0 CA--C 1.551 0.988 0 CA-C-N 114.055 -1.43 . . . . 71.230000000000004 109.603 -175.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 43.4 p90 -132.52 153.59 50.79 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.987 0.915 . . . . 73.549999999999997 110.344 -174.88 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.478 HD13 HD13 ' A' ' 79' ' ' ILE . 46.0 tp -131.64 117.96 19.39 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 124.221 1.008 . . . . 63.030000000000001 109.524 -175.855 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.514 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 28.9 m -105.16 111.43 24.19 Favored 'General case' 0 CA--C 1.539 0.541 0 N-CA-C 109.288 -0.634 . . . . 75.0 109.288 -178.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.511 HG13 HD13 ' A' ' 101' ' ' ILE . 22.4 mm -88.01 126.99 41.44 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 C-N-CA 123.31 0.644 . . . . 73.540000000000006 109.335 -175.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -104.2 109.61 21.5 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.227 -1.027 . . . . 62.409999999999997 108.227 174.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.402 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.84 166.24 10.62 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 123.617 0.767 . . . . 61.210000000000001 111.047 -179.918 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -69.42 142.91 53.75 Favored 'General case' 0 C--O 1.237 0.439 0 O-C-N 124.214 0.946 . . . . 63.140000000000001 110.117 175.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -54.9 -29.25 55.41 Favored 'General case' 0 CA--C 1.554 1.122 0 C-N-CA 124.494 1.118 . . . . 71.129999999999995 113.429 -173.564 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 90.6 mmm -83.54 -31.72 26.25 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.128 0.571 . . . . 65.010000000000005 111.913 -178.584 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.545 HG12 HD11 ' A' ' 97' ' ' ILE . 17.9 t -88.23 122.95 40.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.134 0 N-CA-C 109.592 -0.521 . . . . 70.209999999999994 109.592 -170.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -95.18 152.02 18.71 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.243 0.617 . . . . 61.439999999999998 111.281 -166.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 95.0 m95 -62.3 -26.21 68.29 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.725 0.81 . . . . 73.140000000000001 112.683 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -51.74 -33.42 34.62 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.024 0.929 . . . . 72.319999999999993 112.487 -178.478 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 43.0 p -91.46 -45.49 8.51 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.302 0.641 . . . . 74.519999999999996 111.416 178.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.545 HD11 HG12 ' A' ' 92' ' ' VAL . 4.9 mt -79.89 -47.15 21.94 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.111 0 C-N-CA 122.409 0.283 . . . . 74.409999999999997 110.959 -163.775 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 50.9 tttm -50.77 -53.17 49.87 Favored Pre-proline 0 N--CA 1.487 1.389 0 N-CA-C 114.845 1.424 . . . . 73.430000000000007 114.845 -170.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -59.32 -36.19 95.09 Favored 'Trans proline' 0 C--N 1.385 2.461 0 C-N-CA 121.784 1.656 . . . . 74.340000000000003 112.396 -177.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.421 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 45.2 mt-10 -76.83 -30.84 56.52 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 114.819 -1.082 . . . . 64.010000000000005 111.503 -177.138 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.511 HD13 HG13 ' A' ' 86' ' ' ILE . 69.1 mt -66.32 -52.7 44.35 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 N-CA-C 109.604 -0.517 . . . . 74.439999999999998 109.604 173.015 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.403 HG23 ' HB ' ' A' ' 19' ' ' ILE . 73.6 mt -57.66 -37.41 58.91 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 O-C-N 123.967 0.792 . . . . 72.129999999999995 110.745 -178.032 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -58.97 -44.22 91.49 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.931 0.893 . . . . 65.530000000000001 111.165 175.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.421 ' HG ' ' O ' ' A' ' 100' ' ' GLU . 81.8 mt -67.72 -33.35 74.71 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.673 0.789 . . . . 54.119999999999997 111.548 177.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.5 HD12 HD11 ' A' ' 63' ' ' LEU . 11.1 mp -70.09 -22.7 63.01 Favored 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 123.14 0.576 . . . . 54.039999999999999 110.696 174.225 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.458 ' HA ' ' HB ' ' A' ' 17' ' ' ILE . 25.3 m -82.45 -35.83 27.15 Favored 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 109.459 -0.571 . . . . 73.129999999999995 109.459 177.653 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 50.7 mttp -71.87 -64.23 0.98 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.187 0.595 . . . . 64.209999999999994 111.798 178.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.453 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 2.8 tt0 -58.79 -48.65 80.51 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 123.149 0.579 . . . . 73.209999999999994 112.1 -167.181 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 92.9 mt -60.87 -25.46 66.69 Favored 'General case' 0 CA--C 1.552 1.042 0 O-C-N 124.072 0.858 . . . . 55.520000000000003 111.919 -176.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -73.05 -30.1 63.47 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.52 0.728 . . . . 75.530000000000001 111.332 176.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 92.4 m-85 -87.45 -27.44 22.7 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.265 0.626 . . . . 73.200000000000003 110.463 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 177.28 123.86 0.81 Allowed Glycine 0 C--N 1.341 0.841 0 N-CA-C 111.492 -0.643 . . . . 54.5 111.492 -176.349 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.52 -26.34 67.86 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.186 0.994 . . . . 73.340000000000003 112.118 179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -60.59 102.16 0.17 Allowed 'General case' 0 CA--C 1.545 0.781 0 O-C-N 123.507 0.505 . . . . 71.319999999999993 110.913 173.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.532 HG13 HG13 ' A' ' 116' ' ' ILE . 8.1 p -61.86 -46.81 95.7 Favored 'Isoleucine or valine' 0 C--N 1.353 0.761 0 N-CA-C 109.365 -0.606 . . . . 74.209999999999994 109.365 169.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.532 HG13 HG13 ' A' ' 115' ' ' VAL . 49.0 mt -100.6 83.71 0.94 Allowed 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 106.216 -1.772 . . . . 63.100000000000001 106.216 171.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 4.4 p -71.67 101.74 2.61 Favored 'General case' 0 CA--C 1.536 0.433 0 N-CA-C 108.258 -1.016 . . . . 70.450000000000003 108.258 175.116 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -66.42 -51.15 59.91 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.262 -0.427 . . . . 72.400000000000006 111.094 -175.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 12.3 tp10 . . . . . 0 C--O 1.252 1.202 0 C-N-CA 124.817 1.247 . . . . 74.5 107.714 -179.331 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.2 ptm . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.544 -0.539 . . . . 72.019999999999996 109.544 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 167.2 80.99 0.05 OUTLIER Glycine 0 C--N 1.346 1.135 0 N-CA-C 111.896 -0.482 . . . . 74.049999999999997 111.896 -177.745 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.1 t-80 -82.25 75.35 9.18 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.688 0.795 . . . . 74.150000000000006 109.885 -178.428 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -146.64 153.62 40.52 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 124.713 1.205 . . . . 73.209999999999994 109.746 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -159.98 105.87 1.58 Allowed 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 124.16 0.984 . . . . 73.319999999999993 109.292 -176.83 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 44.6 m80 -105.73 144.02 33.06 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.526 0.73 . . . . 55.200000000000003 109.731 -177.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -84.5 115.56 22.64 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 108.879 -0.786 . . . . 75.510000000000005 108.879 179.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -127.14 131.22 50.81 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 123.586 0.754 . . . . 74.200000000000003 109.874 179.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 75.4 m -154.16 87.92 1.22 Allowed 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 124.514 1.126 . . . . 70.310000000000002 108.887 176.427 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 24.1 m80 -97.39 122.1 40.05 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.258 0.623 . . . . 73.409999999999997 109.546 176.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -80.79 69.02 7.25 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.699 0.8 . . . . 73.140000000000001 109.964 178.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -77.01 -26.95 54.41 Favored 'General case' 0 N--CA 1.475 0.824 0 CA-C-N 115.062 -0.972 . . . . 72.019999999999996 110.96 -177.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 37.0 p -73.9 87.39 1.79 Allowed 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 109.003 -0.74 . . . . 74.310000000000002 109.003 170.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 3.5 pp0? -152.41 149.04 28.17 Favored 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 124.352 1.061 . . . . 62.240000000000002 109.827 -179.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 23.8 mmt180 -102.04 99.8 10.0 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 122.999 0.52 . . . . 74.239999999999995 109.677 176.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.452 ' HA ' HG21 ' A' ' 106' ' ' THR . 2.3 pt? -58.48 120.71 9.3 Favored 'General case' 0 CA--C 1.549 0.935 0 O-C-N 123.918 0.761 . . . . 73.439999999999998 109.67 174.15 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 72.2 mt -75.44 135.67 26.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 C-N-CA 124.438 1.095 . . . . 74.239999999999995 109.965 -170.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 58.7 m80 -67.67 115.44 7.25 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 124.229 1.012 . . . . 72.140000000000001 109.91 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 40.8 mm -128.99 114.69 33.56 Favored 'Isoleucine or valine' 0 C--O 1.239 0.542 0 N-CA-C 105.272 -2.121 . . . . 75.349999999999994 105.272 -179.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -100.06 137.14 38.92 Favored 'General case' 0 CA--C 1.534 0.354 0 N-CA-C 109.273 -0.64 . . . . 64.019999999999996 109.273 -172.544 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 92.2 m -92.15 120.67 32.97 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 123.832 0.853 . . . . 73.319999999999993 109.852 -176.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 71.1 mt -128.62 137.95 51.94 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 124.135 0.974 . . . . 75.329999999999998 108.819 -179.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 44.5 p -87.55 147.25 25.42 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.018 0.527 . . . . 64.25 110.084 179.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 32.5 p -109.96 165.92 11.75 Favored Pre-proline 0 CA--C 1.554 1.131 0 N-CA-C 108.796 -0.816 . . . . 55.329999999999998 108.796 178.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -66.42 -16.68 52.04 Favored 'Trans proline' 0 C--N 1.383 2.356 0 C-N-CA 122.008 1.805 . . . . 71.230000000000004 111.849 169.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -79.72 135.28 36.49 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.209 1.003 . . . . 65.219999999999999 109.347 178.025 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -80.94 147.91 30.06 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 122.949 0.5 . . . . 73.209999999999994 109.747 177.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 55.44 23.91 6.26 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 124.575 1.15 . . . . 73.200000000000003 112.631 -178.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -128.55 121.61 29.18 Favored 'General case' 0 C--O 1.239 0.522 0 C-N-CA 124.742 1.217 . . . . 62.409999999999997 107.959 179.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.6 tp -126.93 125.46 41.58 Favored 'General case' 0 N--CA 1.475 0.806 0 N-CA-C 109.677 -0.49 . . . . 74.120000000000005 109.677 -173.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -82.82 107.24 15.29 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.248 1.019 . . . . 71.200000000000003 110.462 -177.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -93.46 116.12 28.66 Favored 'General case' 0 N--CA 1.466 0.36 0 N-CA-C 108.203 -1.036 . . . . 75.120000000000005 108.203 173.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 43.7 tp -102.75 125.54 49.53 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 123.52 0.728 . . . . 75.319999999999993 109.181 -173.823 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.1 p -73.71 102.56 4.0 Favored 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 107.611 -1.255 . . . . 75.200000000000003 107.611 170.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.6 m -82.44 -33.01 28.7 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.981 0.913 . . . . 74.129999999999995 111.741 -164.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -60.49 -41.14 93.65 Favored 'General case' 0 N--CA 1.488 1.454 0 C-N-CA 123.337 0.655 . . . . 60.530000000000001 111.537 177.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 137.76 7.43 1.39 Allowed Glycine 0 C--N 1.342 0.872 0 CA-C-O 119.097 -0.835 . . . . 62.539999999999999 114.032 178.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 35.6 mm-40 -64.31 151.0 44.99 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 117.67 0.735 . . . . 73.140000000000001 109.795 175.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 17.0 ttt -125.88 131.07 52.44 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 109.453 -0.573 . . . . 65.25 109.453 -178.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 77.4 mt -95.05 -46.84 6.64 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.432 0.693 . . . . 73.420000000000002 111.462 -171.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.435 ' NE2' HG13 ' A' ' 48' ' ' ILE . 6.3 tp-100 -109.88 138.93 45.55 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 123.028 0.531 . . . . 72.040000000000006 110.305 175.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 29.6 m -63.63 125.31 23.87 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 124.493 1.121 . . . . 62.450000000000003 108.862 167.813 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 56.6 ttt180 -64.15 -22.16 66.83 Favored 'General case' 0 N--CA 1.486 1.374 0 N-CA-C 113.478 0.918 . . . . 73.230000000000004 113.478 -164.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -92.22 21.52 37.13 Favored Glycine 0 CA--C 1.529 0.913 0 CA-C-O 119.697 -0.502 . . . . 72.099999999999994 113.547 178.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 26.0 t -132.0 167.75 19.12 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 123.605 0.762 . . . . 73.420000000000002 110.587 -178.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -80.17 155.62 27.34 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 124.055 0.942 . . . . 75.519999999999996 112.103 -174.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 18.2 m -67.29 107.63 2.45 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.01 0.924 . . . . 73.120000000000005 110.147 175.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.435 HG13 ' NE2' ' A' ' 41' ' ' GLN . 39.4 mt -73.85 100.67 1.44 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 N-CA-C 109.694 -0.484 . . . . 62.530000000000001 109.694 -175.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.2 t -84.51 106.67 14.9 Favored 'Isoleucine or valine' 0 C--O 1.24 0.558 0 N-CA-C 107.975 -1.12 . . . . 74.329999999999998 107.975 175.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.474 HG23 ' HB3' ' A' ' 57' ' ' LEU . 54.5 mt -95.49 106.87 18.8 Favored 'Isoleucine or valine' 0 C--N 1.34 0.153 0 N-CA-C 107.828 -1.175 . . . . 73.450000000000003 107.828 -175.614 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.447 ' HE3' ' HB2' ' A' ' 54' ' ' ASP . 47.1 mtmt -91.64 135.39 33.91 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 109.161 -0.681 . . . . 72.319999999999993 109.161 -177.424 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.444 ' ND2' ' HA ' ' A' ' 75' ' ' GLU . 36.1 p30 -63.12 -23.58 67.51 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.169 0.587 . . . . 61.219999999999999 111.814 177.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 15.4 t -80.97 -13.96 58.4 Favored 'General case' 0 CA--C 1.549 0.938 0 C-N-CA 123.898 0.879 . . . . 64.120000000000005 111.469 178.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.447 ' HB2' ' HE3' ' A' ' 51' ' ' LYS . 12.8 t0 -111.38 79.27 1.19 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 108.116 -1.068 . . . . 65.120000000000005 108.116 -179.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.5 tp10 -55.58 -32.68 63.26 Favored 'General case' 0 N--CA 1.486 1.364 0 C-N-CA 125.627 1.571 . . . . 55.310000000000002 113.609 -169.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 33.4 p-10 -62.45 -31.58 72.32 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.076 0.951 . . . . 55.439999999999998 111.928 -179.186 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.474 ' HB3' HG23 ' A' ' 50' ' ' ILE . 75.4 mt -67.77 -35.46 78.74 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.846 0.858 . . . . 75.140000000000001 111.518 174.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.0 mp -70.98 -48.72 54.29 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.049 0 N-CA-C 108.554 -0.906 . . . . 74.319999999999993 108.554 178.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -54.1 -31.14 51.13 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.803 1.241 . . . . 64.239999999999995 112.726 -176.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.5 m170 -86.99 -45.67 10.55 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.059 0.543 . . . . 51.329999999999998 110.996 177.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.459 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 22.2 m -87.35 106.1 17.71 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.081 0.553 . . . . 74.430000000000007 111.792 -172.246 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 9.0 ttmm -49.61 -52.2 32.14 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 125.542 1.537 . . . . 74.319999999999993 112.726 179.257 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.638 HD11 HD12 ' A' ' 105' ' ' LEU . 33.7 tp -61.79 -36.0 79.8 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 114.699 -1.137 . . . . 71.0 111.451 -177.454 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.429 ' HA ' HD11 ' A' ' 77' ' ' LEU . . . -65.32 -41.3 94.14 Favored 'General case' 0 C--N 1.352 0.703 0 C-N-CA 123.236 0.614 . . . . 75.439999999999998 111.161 178.216 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.459 ' HG3' ' O ' ' A' ' 61' ' ' SER . 78.5 mt-30 -56.21 -49.97 72.59 Favored 'General case' 0 C--N 1.352 0.684 0 O-C-N 124.143 0.902 . . . . 74.430000000000007 109.901 178.25 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.467 ' HB3' HD22 ' A' ' 104' ' ' LEU . 29.5 mm-40 -61.17 -50.75 71.87 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.305 1.042 . . . . 61.450000000000003 113.38 179.026 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 74.1 mt -66.17 -46.78 86.68 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.225 0 C-N-CA 122.839 0.456 . . . . 70.040000000000006 111.131 -174.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -70.42 -30.47 67.34 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 122.867 0.467 . . . . 73.040000000000006 112.054 178.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 63.9 tp -68.51 -58.79 3.78 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.75 0.42 . . . . 73.340000000000003 110.464 178.639 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 75.2 mt-30 -77.23 -19.54 56.49 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.563 -0.744 . . . . 71.230000000000004 112.015 -175.043 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.496 ' SG ' HG23 ' A' ' 97' ' ' ILE . 63.8 m -139.45 81.32 20.54 Favored Pre-proline 0 CA--C 1.554 1.127 0 N-CA-C 109.103 -0.703 . . . . 72.439999999999998 109.103 176.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -66.4 -6.93 16.18 Favored 'Trans proline' 0 C--N 1.378 2.119 0 C-N-CA 122.988 2.459 . . . . 64.430000000000007 113.749 177.074 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -79.55 -7.37 88.54 Favored Glycine 0 C--N 1.353 1.475 0 CA-C-O 120.016 -0.325 . . . . 72.319999999999993 113.124 178.141 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 98.8 t -79.21 130.61 35.87 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.783 0 C-N-CA 123.609 0.764 . . . . 72.400000000000006 109.225 172.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . 0.444 ' HA ' ' ND2' ' A' ' 52' ' ' ASN . 20.7 mm-40 -87.09 -46.76 9.49 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.145 0.978 . . . . 72.450000000000003 111.478 -176.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.7 p -157.88 156.53 31.54 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 115.697 -0.683 . . . . 73.549999999999997 110.838 -176.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . 0.429 HD11 ' HA ' ' A' ' 64' ' ' ALA . 38.8 mt -108.18 167.21 10.17 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 107.931 -1.137 . . . . 73.319999999999993 107.931 171.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.587 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 52.9 ttm -142.8 103.89 4.26 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 106.871 -1.529 . . . . 70.109999999999999 106.871 169.64 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.487 HD13 HD13 ' A' ' 84' ' ' LEU . 28.9 mm -77.21 100.74 2.84 Favored 'Isoleucine or valine' 0 C--O 1.243 0.742 0 N-CA-C 107.73 -1.211 . . . . 73.340000000000003 107.73 -177.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -94.15 173.02 32.63 Favored Glycine 0 C--O 1.241 0.568 0 N-CA-C 110.645 -0.982 . . . . 70.109999999999999 110.645 177.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -55.68 -66.61 0.39 Allowed 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.901 0.881 . . . . 42.049999999999997 110.351 -173.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.7 p-10 -105.05 -0.74 26.46 Favored 'General case' 0 N--CA 1.472 0.648 0 CA-C-N 114.144 -1.389 . . . . 72.019999999999996 110.984 -176.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 38.3 p90 -137.7 168.16 20.24 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 122.947 0.499 . . . . 74.349999999999994 111.709 -166.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.487 HD13 HD13 ' A' ' 79' ' ' ILE . 48.9 tp -139.4 114.19 9.34 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 124.23 1.012 . . . . 70.150000000000006 108.71 176.301 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.587 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 31.0 m -96.13 106.63 18.84 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 108.481 -0.933 . . . . 74.439999999999998 108.481 -178.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.532 HG13 HD13 ' A' ' 101' ' ' ILE . 20.2 mm -87.87 117.96 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 N-CA-C 108.103 -1.073 . . . . 65.109999999999999 108.103 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 26.3 m-80 -104.58 125.7 50.96 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 107.522 -1.288 . . . . 70.430000000000007 107.522 174.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.403 ' HA ' ' H ' ' A' ' 75' ' ' GLU . 0.0 OUTLIER -134.46 169.89 16.57 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.553 0.741 . . . . 62.520000000000003 110.841 -174.911 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -81.37 142.51 32.96 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-N 115.535 -0.757 . . . . 71.010000000000005 109.263 178.792 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 17.0 ptp180 -80.25 0.96 30.41 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.893 0.877 . . . . 74.299999999999997 112.906 -173.559 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 23.1 ptp -78.34 -22.53 47.9 Favored 'General case' 0 N--CA 1.485 1.308 0 CA-C-O 120.679 0.276 . . . . 73.25 110.552 171.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 18.9 t -102.54 147.35 9.23 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 123.743 0.817 . . . . 61.229999999999997 109.666 -179.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -76.14 158.67 31.49 Favored 'General case' 0 CA--C 1.564 1.488 0 C-N-CA 124.1 0.96 . . . . 62.219999999999999 110.618 177.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 2.2 m95 -82.04 -56.03 4.2 Favored 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.703 0.801 . . . . 72.120000000000005 112.179 -179.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -60.8 -18.8 57.54 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 124.563 1.145 . . . . 72.340000000000003 112.276 -177.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 71.9 p -77.04 -39.29 50.61 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.673 0.789 . . . . 74.129999999999995 110.647 177.788 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.496 HG23 ' SG ' ' A' ' 71' ' ' CYS . 28.8 mt -79.93 -29.55 12.83 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.281 0 C-N-CA 123.631 0.772 . . . . 74.329999999999998 110.655 178.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.4 ttpm? -57.74 -45.2 99.84 Favored Pre-proline 0 CA--C 1.578 2.029 0 N-CA-C 114.608 1.336 . . . . 74.209999999999994 114.608 -169.726 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -62.72 -32.81 78.28 Favored 'Trans proline' 0 C--N 1.398 3.169 0 CA-C-N 122.185 1.816 . . . . 73.349999999999994 111.557 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 10.3 mm-40 -63.29 -51.25 66.86 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.888 0.875 . . . . 73.549999999999997 110.019 174.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.532 HD13 HG13 ' A' ' 86' ' ' ILE . 83.2 mt -58.65 -56.05 19.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.224 0 C-N-CA 123.495 0.718 . . . . 74.219999999999999 110.684 -178.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 67.4 mt -55.61 -39.57 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.185 0 C-N-CA 123.727 0.811 . . . . 73.310000000000002 111.173 179.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.72 -50.95 69.09 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 123.336 0.654 . . . . 75.409999999999997 111.01 178.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.467 HD22 ' HB3' ' A' ' 66' ' ' GLN . 74.4 mt -67.13 -32.7 74.0 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 124.11 0.964 . . . . 73.319999999999993 111.883 -176.705 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.638 HD12 HD11 ' A' ' 63' ' ' LEU . 9.5 mp -69.88 -29.17 66.32 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.683 0.793 . . . . 65.140000000000001 109.998 173.555 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.452 HG21 ' HA ' ' A' ' 16' ' ' LEU . 52.4 m -74.94 -45.51 41.93 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 109.689 -0.485 . . . . 71.519999999999996 109.689 176.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 32.5 mmmt -60.04 -49.89 75.87 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 124.166 0.986 . . . . 74.25 110.793 -176.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.551 HE21 ' HA ' ' A' ' 115' ' ' VAL . 36.4 tt0 -53.29 -59.2 4.87 Favored 'General case' 0 N--CA 1.477 0.898 0 O-C-N 124.395 1.059 . . . . 73.409999999999997 111.065 177.18 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 59.7 mt -72.94 -13.5 61.26 Favored 'General case' 0 CA--C 1.55 0.974 0 CA-C-N 114.915 -1.039 . . . . 64.209999999999994 111.691 -172.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -75.36 -27.76 59.29 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.98 0.912 . . . . 74.209999999999994 111.143 174.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -87.41 -43.95 11.71 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.076 0.55 . . . . 75.439999999999998 109.571 173.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -178.13 159.21 24.61 Favored Glycine 0 C--N 1.344 0.983 0 CA-C-N 115.544 -0.753 . . . . 51.200000000000003 112.587 178.687 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -62.08 -29.0 70.01 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 124.402 1.081 . . . . 61.399999999999999 112.426 -178.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -59.9 140.69 56.49 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.233 1.013 . . . . 72.219999999999999 112.626 -172.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.551 ' HA ' HE21 ' A' ' 108' ' ' GLN . 8.6 p -85.02 -43.4 16.96 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.718 0 N-CA-C 108.576 -0.898 . . . . 64.219999999999999 108.576 168.342 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 20.4 mt -143.64 96.95 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 N-CA-C 107.416 -1.328 . . . . 72.439999999999998 107.416 173.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 15.1 p -66.19 -62.54 1.42 Allowed 'General case' 0 N--CA 1.489 1.508 0 CA-C-O 121.85 0.833 . . . . 74.040000000000006 108.805 172.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 64.4 pttt -137.74 8.53 2.81 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 113.72 -1.582 . . . . 75.430000000000007 107.685 158.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 . . . . . 0 CA--C 1.55 0.948 0 C-N-CA 126.441 1.897 . . . . 75.340000000000003 106.614 -169.594 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.2 mpp? . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.484 -0.562 . . . . 74.010000000000005 109.484 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 129.85 105.13 1.12 Allowed Glycine 0 C--N 1.353 1.49 0 N-CA-C 111.859 -0.497 . . . . 72.099999999999994 111.859 -179.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.8 m80 -144.09 106.59 4.41 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 124.131 0.972 . . . . 73.230000000000004 109.318 176.238 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 62.2 m80 -74.85 124.78 27.48 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.069 0.548 . . . . 71.010000000000005 109.665 175.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 61.6 m80 -93.04 105.66 17.72 Favored 'General case' 0 N--CA 1.472 0.656 0 N-CA-C 107.98 -1.119 . . . . 64.319999999999993 107.98 175.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 24.9 t-80 -66.11 111.25 3.31 Favored 'General case' 0 C--O 1.243 0.745 0 O-C-N 123.765 0.666 . . . . 63.439999999999998 109.96 -176.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 92.4 m-70 -61.54 124.36 20.43 Favored 'General case' 0 C--N 1.348 0.514 0 O-C-N 124.234 0.959 . . . . 64.219999999999999 108.807 174.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 21.1 m80 -84.13 166.24 17.8 Favored 'General case' 0 C--O 1.243 0.729 0 C-N-CA 123.837 0.855 . . . . 74.010000000000005 109.962 -173.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.1 t -61.74 126.16 26.36 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 108.939 -0.763 . . . . 61.329999999999998 108.939 172.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 49.0 m80 -72.79 78.88 1.12 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.229 0.612 . . . . 74.129999999999995 110.256 -174.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.2 ttt -77.38 114.77 16.55 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.64 -0.709 . . . . 74.439999999999998 110.264 -175.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -124.17 35.19 4.87 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.418 1.087 . . . . 64.239999999999995 109.356 179.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.4 m -78.19 4.78 11.71 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.743 -1.117 . . . . 75.019999999999996 112.443 -173.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -62.48 87.45 0.02 OUTLIER 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.367 1.067 . . . . 73.409999999999997 110.588 177.748 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 48.1 ttt180 -113.6 69.83 0.71 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 108.41 -0.959 . . . . 72.239999999999995 108.41 178.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -161.37 163.76 30.44 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 114.353 -1.294 . . . . 71.349999999999994 109.137 175.006 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 75.8 mt -94.91 130.0 44.29 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.464 0 N-CA-C 107.778 -1.193 . . . . 64.340000000000003 107.778 174.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 20.2 t-80 -75.69 112.38 12.0 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 123.433 0.693 . . . . 72.120000000000005 109.877 -169.098 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 44.8 mm -119.97 112.23 35.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.56 0 N-CA-C 107.717 -1.216 . . . . 73.120000000000005 107.717 -172.094 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.506 ' HB3' ' HB3' ' A' ' 33' ' ' LEU . 24.2 ttmm -91.99 126.55 37.11 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.932 0.893 . . . . 72.239999999999995 109.514 -173.079 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 91.9 m -90.28 120.6 31.56 Favored 'General case' 0 C--O 1.239 0.506 0 N-CA-C 108.837 -0.801 . . . . 71.109999999999999 108.837 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.415 ' HB2' ' HG3' ' A' ' 31' ' ' LYS . 97.7 mt -128.04 139.6 52.44 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 124.043 0.937 . . . . 62.240000000000002 109.071 -179.232 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 72.4 p -83.68 160.94 21.22 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.166 0.586 . . . . 74.439999999999998 110.192 177.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 43.1 p -115.77 162.25 26.36 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 108.664 -0.865 . . . . 74.209999999999994 108.664 175.558 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -58.37 -16.35 28.45 Favored 'Trans proline' 0 C--N 1.377 2.027 0 C-N-CA 122.844 2.363 . . . . 72.329999999999998 113.37 167.082 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.445 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 28.0 t-20 -84.26 151.02 25.05 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.308 0.643 . . . . 64.519999999999996 110.723 176.34 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 8.2 pt-20 -67.04 -52.85 37.25 Favored 'General case' 0 CA--C 1.553 1.08 0 C-N-CA 124.304 1.042 . . . . 62.130000000000003 112.594 -176.824 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -106.97 18.72 21.44 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.678 0.791 . . . . 73.230000000000004 111.253 -168.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.445 ' HB3' ' HB3' ' A' ' 26' ' ' ASN . . . -111.94 128.34 56.13 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.535 0.734 . . . . 34.43 109.272 177.15 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 35.9 tp -137.56 116.23 12.16 Favored 'General case' 0 N--CA 1.477 0.906 0 N-CA-C 107.296 -1.372 . . . . 72.329999999999998 107.296 176.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . 0.424 ' HA ' ' HA ' ' A' ' 85' ' ' THR . 60.9 pttt -94.87 150.07 20.57 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.442 0.639 . . . . 74.140000000000001 111.194 -176.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -124.32 122.52 37.94 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 124.569 1.147 . . . . 60.229999999999997 108.113 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.506 ' HB3' ' HB3' ' A' ' 20' ' ' LYS . 26.7 tp -104.12 126.64 51.39 Favored 'General case' 0 C--O 1.241 0.657 0 C-N-CA 124.003 0.921 . . . . 72.010000000000005 109.613 -165.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.5 p -85.24 106.56 16.75 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.424 0.689 . . . . 65.329999999999998 109.142 177.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 76.6 p -96.14 -8.42 33.27 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 123.385 0.674 . . . . 63.030000000000001 112.66 -170.008 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -80.32 -32.8 37.91 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.75 0.82 . . . . 74.150000000000006 112.858 -169.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 121.41 -23.1 7.68 Favored Glycine 0 N--CA 1.475 1.248 0 N-CA-C 111.048 -0.821 . . . . 71.319999999999993 111.048 -171.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -68.06 96.76 0.64 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 108.456 -0.942 . . . . 75.150000000000006 108.456 168.08 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.8 ttt -79.71 139.24 37.41 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.593 0.757 . . . . 73.430000000000007 109.194 -179.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.579 HD23 HD21 ' A' ' 109' ' ' LEU . 87.9 mt -60.1 -34.55 73.63 Favored 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 123.202 0.601 . . . . 63.450000000000003 112.2 -178.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.58 HE22 HD12 ' A' ' 48' ' ' ILE . 25.6 tt0 -175.1 157.57 2.31 Favored 'General case' 0 C--O 1.24 0.583 0 O-C-N 124.3 1.0 . . . . 65.219999999999999 109.672 -177.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.2 t -50.11 144.85 6.47 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 124.61 1.164 . . . . 60.219999999999999 111.907 173.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 35.2 ptt-85 -65.35 -16.67 63.83 Favored 'General case' 0 CA--C 1.545 0.773 0 CA-C-N 114.82 -1.082 . . . . 62.420000000000002 112.111 179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -63.99 -13.76 53.77 Favored Glycine 0 C--N 1.359 1.837 0 N-CA-C 114.654 0.621 . . . . 71.239999999999995 114.654 179.309 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 76.7 p -75.06 161.61 29.28 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.325 0.65 . . . . 51.350000000000001 110.146 171.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.36 73.14 1.44 Allowed 'General case' 0 N--CA 1.488 1.46 0 CA-C-O 121.432 0.634 . . . . 72.109999999999999 111.772 -174.222 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 62.2 m 51.85 69.33 0.68 Allowed 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.286 1.034 . . . . 72.239999999999995 111.488 -178.512 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.58 HD12 HE22 ' A' ' 41' ' ' GLN . 57.6 mt -75.85 99.21 1.76 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 N-CA-C 109.587 -0.523 . . . . 62.409999999999997 109.587 -175.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 94.0 t -80.25 124.2 37.93 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 N-CA-C 108.196 -1.038 . . . . 65.409999999999997 108.196 179.555 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.542 HD11 HD11 ' A' ' 116' ' ' ILE . 45.7 mt -105.02 109.37 27.46 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.438 0 N-CA-C 108.29 -1.004 . . . . 72.439999999999998 108.29 -179.468 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 97.1 mttt -79.6 140.2 37.22 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 109.736 -0.468 . . . . 73.439999999999998 109.736 -179.644 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 37.5 p30 -65.75 -23.83 66.82 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 122.784 0.433 . . . . 75.549999999999997 111.388 176.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 8.9 t -85.58 -19.61 30.8 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.725 0.81 . . . . 61.210000000000001 111.791 178.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -92.35 95.39 9.65 Favored 'General case' 0 N--CA 1.479 0.995 0 N-CA-C 108.572 -0.899 . . . . 73.230000000000004 108.572 -177.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -53.08 -40.15 63.85 Favored 'General case' 0 CA--C 1.553 1.074 0 C-N-CA 124.369 1.068 . . . . 72.230000000000004 113.023 178.185 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -67.43 -44.15 79.43 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.514 0.726 . . . . 73.310000000000002 112.162 -169.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 97.7 mt -61.84 -35.09 77.25 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 123.464 0.706 . . . . 53.020000000000003 111.31 177.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.507 HG22 ' HG2' ' A' ' 65' ' ' GLN . 53.7 mt -77.71 -34.0 19.59 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.929 0 CA-C-N 115.068 -0.969 . . . . 72.329999999999998 110.205 -178.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 14.7 m120 -59.62 -36.44 76.32 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 123.181 0.592 . . . . 70.299999999999997 111.268 174.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.7 m170 -74.75 -39.23 61.95 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.499 0.72 . . . . 64.019999999999996 111.117 178.242 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.559 ' HB2' HD13 ' A' ' 116' ' ' ILE . 43.7 t -104.45 98.78 8.51 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.431 0.692 . . . . 73.25 110.646 -176.873 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -61.13 -32.31 72.01 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.939 0.496 . . . . 73.5 110.659 173.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 38.0 tp -58.27 -40.33 81.56 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 124.024 0.93 . . . . 64.409999999999997 110.713 174.056 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -66.04 -40.93 91.42 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.209 0.604 . . . . 64.129999999999995 111.544 175.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.507 ' HG2' HG22 ' A' ' 58' ' ' ILE . 91.9 mt-30 -55.68 -47.08 77.35 Favored 'General case' 0 N--CA 1.484 1.236 0 O-C-N 123.901 0.751 . . . . 73.329999999999998 110.162 178.476 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.5 mm-40 -62.99 -51.03 68.44 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.956 -1.02 . . . . 72.310000000000002 112.84 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 86.5 mt -65.05 -45.83 93.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.284 0 C-N-CA 123.062 0.545 . . . . 64.349999999999994 111.291 -174.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -69.37 -33.06 72.49 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 122.791 0.436 . . . . 71.019999999999996 112.053 179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 52.8 tp -70.99 -42.69 69.32 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 122.709 0.404 . . . . 74.430000000000007 111.192 177.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . 0.451 HE22 HD21 ' A' ' 104' ' ' LEU . 78.7 mt-30 -74.95 -26.67 59.77 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.164 0.586 . . . . 72.439999999999998 111.475 -178.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . . . . . . . . . 53.5 t -146.88 103.58 3.88 Favored Pre-proline 0 CA--C 1.547 0.836 0 C-N-CA 122.826 0.45 . . . . 74.030000000000001 110.074 178.42 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 88.9 Cg_endo -78.73 7.23 4.36 Favored 'Trans proline' 0 C--N 1.373 1.866 0 C-N-CA 122.757 2.305 . . . . 63.539999999999999 112.928 173.862 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -78.51 -25.76 60.39 Favored Glycine 0 C--N 1.35 1.318 0 N-CA-C 112.149 -0.38 . . . . 71.439999999999998 112.149 171.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.497 ' HA ' ' HA ' ' A' ' 88' ' ' LYS . 42.2 t -69.43 121.96 19.97 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 C-N-CA 123.186 0.594 . . . . 52.140000000000001 110.167 -179.645 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.2 mm-40 -74.49 -48.33 27.89 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.252 1.021 . . . . 74.239999999999995 110.538 -178.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 62.0 p -162.81 166.42 24.2 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.607 -1.178 . . . . 62.219999999999999 110.326 -173.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 59.2 mt -111.69 169.86 8.54 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 108.0 -1.111 . . . . 75.319999999999993 108.0 171.322 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.528 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 56.0 ttm -143.14 115.43 8.46 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 107.517 -1.29 . . . . 72.349999999999994 107.517 170.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.541 HD13 HD13 ' A' ' 84' ' ' LEU . 42.7 mm -84.89 104.64 13.23 Favored 'Isoleucine or valine' 0 C--O 1.238 0.487 0 N-CA-C 107.943 -1.132 . . . . 51.530000000000001 107.943 179.333 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -85.46 173.31 47.75 Favored Glycine 0 C--O 1.244 0.751 0 N-CA-C 109.442 -1.463 . . . . 52.130000000000003 109.442 167.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -61.32 -52.39 64.88 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 123.224 0.61 . . . . 64.219999999999999 110.724 -176.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -123.96 5.06 8.67 Favored 'General case' 0 CA--C 1.558 1.261 0 CA-C-N 115.368 -0.833 . . . . 73.340000000000003 111.879 -176.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 19.4 p90 -140.2 133.92 30.41 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 122.982 0.513 . . . . 74.099999999999994 110.379 -175.045 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.663 HD23 HD11 ' A' ' 105' ' ' LEU . 32.8 tp -103.27 114.61 29.03 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 109.445 -0.576 . . . . 60.439999999999998 109.445 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.528 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 18.4 m -97.81 113.27 25.02 Favored 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 123.35 0.66 . . . . 73.310000000000002 109.558 -177.429 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.608 HG13 HD13 ' A' ' 101' ' ' ILE . 30.1 mm -89.01 128.35 41.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 108.307 -0.997 . . . . 74.439999999999998 108.307 179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 11.9 m-80 -117.94 110.94 18.33 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 108.366 -0.976 . . . . 71.430000000000007 108.366 -177.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . 0.497 ' HA ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -117.26 174.28 6.21 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 123.053 0.541 . . . . 72.409999999999997 111.332 -174.467 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 13.0 t70 -74.02 131.71 41.65 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 108.511 -0.922 . . . . 61.109999999999999 108.511 172.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 6.6 ptp180 -56.35 -30.37 62.56 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 113.958 1.096 . . . . 73.299999999999997 113.958 -172.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 88.7 mtp -76.79 -9.33 58.6 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 122.98 0.512 . . . . 73.409999999999997 112.228 -176.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 39.6 t -95.77 138.62 20.86 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 C-N-CA 124.323 1.049 . . . . 54.420000000000002 108.475 176.212 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 45.8 m-70 -79.46 160.5 26.56 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.349 0.66 . . . . 75.340000000000003 111.165 -176.216 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 22.7 m95 -80.3 -51.87 8.38 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 123.115 0.566 . . . . 72.230000000000004 112.124 176.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -60.9 -18.19 55.05 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 123.786 0.834 . . . . 70.439999999999998 112.663 -171.753 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 14.9 m -71.46 -49.68 39.1 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.335 0.654 . . . . 62.140000000000001 110.717 175.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . . . . . . . . . 6.7 mt -85.23 -31.1 6.75 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 CA-C-N 115.234 -0.893 . . . . 73.230000000000004 111.043 -173.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 7.2 ttpm? -53.66 -50.11 85.18 Favored Pre-proline 0 CA--C 1.559 1.309 0 C-N-CA 124.566 1.146 . . . . 74.129999999999995 113.993 -167.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -58.96 -35.86 97.85 Favored 'Trans proline' 0 C--N 1.385 2.475 0 C-N-CA 122.014 1.81 . . . . 75.329999999999998 112.329 177.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -67.93 -37.86 82.18 Favored 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.601 -0.727 . . . . 74.109999999999999 110.668 -178.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.608 HD13 HG13 ' A' ' 86' ' ' ILE . 69.3 mt -65.51 -54.05 32.59 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.791 0 C-N-CA 123.676 0.79 . . . . 70.239999999999995 109.677 177.564 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 87.3 mt -54.32 -39.34 43.39 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.406 0 C-N-CA 124.053 0.941 . . . . 62.240000000000002 111.317 -177.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.13 -49.1 75.74 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-N 115.087 -0.96 . . . . 72.150000000000006 111.3 178.277 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.451 HD21 HE22 ' A' ' 70' ' ' GLN . 95.0 mt -65.49 -33.46 76.0 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.75 0.82 . . . . 61.43 112.471 -178.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.663 HD11 HD23 ' A' ' 84' ' ' LEU . 9.7 mp -71.78 -27.26 62.83 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 123.251 0.62 . . . . 53.200000000000003 111.324 175.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 99.1 m -72.28 -32.47 66.65 Favored 'General case' 0 CA--C 1.552 1.021 0 N-CA-C 109.379 -0.601 . . . . 73.129999999999995 109.379 173.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.454 ' HA ' ' HE2' ' A' ' 107' ' ' LYS . 9.1 mmpt? -69.28 -45.62 69.21 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.454 0.701 . . . . 64.239999999999995 111.105 177.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.599 HE21 ' HB ' ' A' ' 115' ' ' VAL . 1.1 tm0? -61.12 -54.24 47.02 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.902 0.881 . . . . 64.409999999999997 109.314 -178.888 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.579 HD21 HD23 ' A' ' 40' ' ' LEU . 97.7 mt -74.37 -14.67 60.9 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 114.729 -1.123 . . . . 73.530000000000001 112.26 -174.28 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -61.59 -35.81 78.89 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 122.993 0.517 . . . . 64.319999999999993 110.355 171.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . 0.502 ' HB2' ' HG2' ' A' ' 113' ' ' GLU . 93.0 m-85 -87.09 -34.6 19.08 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 115.486 -0.779 . . . . 64.200000000000003 109.713 171.29 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 79.78 52.02 4.87 Favored Glycine 0 C--N 1.349 1.292 0 N-CA-C 110.685 -0.966 . . . . 51.520000000000003 110.685 -175.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . 0.502 ' HG2' ' HB2' ' A' ' 111' ' ' TYR . 32.5 mm-40 -82.35 154.73 25.11 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 123.521 0.728 . . . . 75.340000000000003 112.412 -172.301 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -89.05 98.72 11.92 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 106.202 -1.777 . . . . 73.239999999999995 106.202 159.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.599 ' HB ' HE21 ' A' ' 108' ' ' GLN . 3.5 p -43.58 -42.88 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 C-N-CA 125.653 1.581 . . . . 75.209999999999994 114.677 -168.556 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.559 HD13 ' HB2' ' A' ' 61' ' ' SER . 43.5 mm -96.46 -71.63 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 123.366 0.666 . . . . 74.400000000000006 109.984 -178.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 28.4 m -145.55 136.12 24.24 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 124.247 1.019 . . . . 71.310000000000002 109.189 -174.565 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 53.7 tttp -92.35 -39.99 11.16 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.779 0.831 . . . . 60.100000000000001 109.57 179.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 CA--C 1.556 1.181 0 C-N-CA 123.991 0.916 . . . . 73.329999999999998 109.041 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.44 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 pmm? . . . . . 0 N--CA 1.487 1.379 0 N-CA-C 109.527 -0.545 . . . . 70.430000000000007 109.527 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -155.63 82.05 0.16 Allowed Glycine 0 C--N 1.348 1.244 0 N-CA-C 112.175 -0.37 . . . . 73.120000000000005 112.175 -176.138 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 26.4 p80 -108.98 19.32 19.7 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 123.681 0.792 . . . . 75.540000000000006 110.178 175.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 77.6 t60 -63.91 129.37 39.78 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.616 1.166 . . . . 70.140000000000001 111.125 -175.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.7 m170 -77.04 141.2 40.41 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.62 0.768 . . . . 74.140000000000001 110.299 -179.071 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -62.23 -52.26 64.48 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.942 0.897 . . . . 75.230000000000004 109.818 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 6.9 t-80 40.29 79.8 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 O-C-N 125.376 1.673 . . . . 73.200000000000003 112.698 170.749 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -85.35 27.71 0.79 Allowed 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.692 1.197 . . . . 74.549999999999997 111.728 -167.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.9 p -66.99 96.27 0.42 Allowed 'General case' 0 CA--C 1.55 0.942 0 C-N-CA 123.613 0.765 . . . . 70.329999999999998 110.428 178.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.5 t60 -76.8 81.43 3.4 Favored 'General case' 0 CA--C 1.548 0.876 0 N-CA-C 108.894 -0.78 . . . . 63.229999999999997 108.894 178.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 18.4 ttt -75.76 106.09 7.14 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 115.753 -0.658 . . . . 75.450000000000003 109.976 -179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 40.5 t30 -76.95 128.0 33.73 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 108.01 -1.108 . . . . 71.430000000000007 108.01 167.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 20.0 m -117.18 -9.45 11.0 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.983 0.913 . . . . 64.340000000000003 110.273 177.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 15.9 mm100 -77.58 171.18 15.32 Favored 'General case' 0 C--N 1.353 0.737 0 C-N-CA 124.361 1.064 . . . . 61.329999999999998 111.334 178.686 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 83.3 mtt180 60.94 36.61 18.72 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.7 1.2 . . . . 70.030000000000001 110.613 -166.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.48 ' H ' HD23 ' A' ' 16' ' ' LEU . 1.2 pt? -79.89 82.0 6.06 Favored 'General case' 0 C--N 1.356 0.849 0 CA-C-O 123.483 1.611 . . . . 74.430000000000007 108.148 169.499 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.488 ' H ' HG23 ' A' ' 106' ' ' THR . 85.6 mt -67.82 105.37 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 CA-C-N 112.489 -2.141 . . . . 74.329999999999998 109.431 -176.547 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 88.3 m-70 -67.61 127.98 34.74 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-N 114.591 -1.186 . . . . 74.219999999999999 109.761 -173.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 49.1 mm -119.95 118.71 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.449 0 N-CA-C 106.491 -1.67 . . . . 60.329999999999998 106.491 -175.467 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 38.8 ttpt -95.06 129.75 42.03 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.23 -1.026 . . . . 71.439999999999998 108.23 -175.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 6.6 t -100.56 130.86 46.68 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 123.489 0.716 . . . . 50.5 109.379 -178.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 87.1 mt -126.67 138.82 53.47 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.377 1.071 . . . . 74.230000000000004 108.668 -178.167 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 40.1 p -73.71 149.2 42.01 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.458 0.703 . . . . 61.030000000000001 110.897 -179.112 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.425 ' HB ' ' HD2' ' A' ' 25' ' ' PRO . 72.6 p -122.89 167.57 14.15 Favored Pre-proline 0 CA--C 1.554 1.098 0 C-N-CA 124.819 1.248 . . . . 64.120000000000005 108.028 -176.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' PRO . . . . . 0.425 ' HD2' ' HB ' ' A' ' 24' ' ' THR . 17.9 Cg_endo -56.78 -18.19 26.1 Favored 'Trans proline' 0 C--N 1.39 2.735 0 C-N-CA 122.364 2.042 . . . . 65.510000000000005 113.426 177.645 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -109.61 133.24 53.33 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.602 0.761 . . . . 71.400000000000006 109.466 176.454 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.33 -21.76 62.88 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 123.283 0.633 . . . . 71.129999999999995 110.185 166.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -59.95 -47.23 86.65 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 125.608 1.563 . . . . 73.030000000000001 110.469 173.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -92.55 160.52 15.0 Favored 'General case' 0 C--O 1.239 0.53 0 CA-C-N 114.3 -1.318 . . . . 52.149999999999999 110.181 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 33.0 tp -158.18 128.55 6.17 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 108.787 -0.82 . . . . 75.030000000000001 108.787 173.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 87.9 tttt -82.37 127.01 32.83 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.988 0.915 . . . . 73.230000000000004 110.358 -176.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PHE . . . . . 0.45 ' CZ ' ' HG3' ' A' ' 98' ' ' LYS . 80.1 m-85 -114.75 116.71 29.09 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 124.562 1.145 . . . . 73.540000000000006 108.344 175.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 39.0 tp -114.8 129.96 56.78 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 124.069 0.948 . . . . 74.200000000000003 109.33 -169.693 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 31.8 t -100.02 103.87 15.43 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 108.126 -1.064 . . . . 42.350000000000001 108.126 174.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.0 p -104.24 -6.61 20.76 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 124.096 0.958 . . . . 73.420000000000002 109.754 176.262 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -61.85 -60.42 3.68 Favored 'General case' 0 C--N 1.35 0.627 0 C-N-CA 124.648 1.179 . . . . 70.299999999999997 111.725 -168.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . -161.1 -81.54 0.04 OUTLIER Glycine 0 C--N 1.338 0.678 0 N-CA-C 111.114 -0.794 . . . . 52.140000000000001 111.114 176.748 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -72.21 119.91 17.08 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 123.471 0.708 . . . . 42.340000000000003 109.659 175.856 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 48.4 ttp -97.38 155.61 16.83 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 115.04 -0.982 . . . . 73.420000000000002 109.332 -176.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 97.1 mt -58.68 -62.29 1.97 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 114.115 1.154 . . . . 74.510000000000005 114.115 -169.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -114.84 -91.9 0.51 Allowed 'General case' 0 N--CA 1.484 1.235 0 CA-C-O 119.233 -0.413 . . . . 52.009999999999998 110.693 -174.086 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 10.6 t 176.44 155.65 0.23 Allowed 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.504 1.122 . . . . 63.549999999999997 109.724 -177.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 26.5 mmm180 -71.52 150.22 45.03 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 122.511 0.324 . . . . 70.209999999999994 110.421 172.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 91.08 12.15 60.53 Favored Glycine 0 C--N 1.344 1.008 0 CA-C-N 116.151 -0.477 . . . . 73.409999999999997 112.447 -175.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 45.1 t -93.03 179.59 5.39 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.577 1.151 . . . . 63.329999999999998 110.623 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.06 -179.02 5.16 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.185 0.994 . . . . 74.540000000000006 109.635 176.19 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 19.8 m -74.61 93.98 2.6 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 123.435 0.694 . . . . 54.25 110.604 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.506 ' HB ' ' HB ' ' A' ' 79' ' ' ILE . 46.6 mt -81.44 97.07 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 N-CA-C 109.126 -0.694 . . . . 65.530000000000001 109.126 175.621 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.1 t -84.21 107.87 15.9 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 108.48 -0.933 . . . . 62.420000000000002 108.48 -178.278 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . 0.506 HG23 ' HB2' ' A' ' 57' ' ' LEU . 55.5 mt -105.61 109.51 28.05 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.419 0 N-CA-C 107.138 -1.43 . . . . 75.120000000000005 107.138 174.401 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 9.8 mtmp? -93.48 171.62 8.79 Favored 'General case' 0 N--CA 1.477 0.904 0 N-CA-C 109.507 -0.553 . . . . 63.439999999999998 109.507 177.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 24.6 p30 -56.75 -25.74 55.61 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.248 1.019 . . . . 73.420000000000002 112.638 177.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 6.8 t -87.12 -17.07 33.64 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 124.031 0.932 . . . . 64.239999999999995 111.466 -178.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -84.17 60.09 5.72 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 123.407 0.683 . . . . 74.140000000000001 110.43 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -61.27 -24.54 66.46 Favored 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 124.278 1.031 . . . . 72.430000000000007 111.577 -176.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 78.8 m-20 -56.18 -51.87 66.44 Favored 'General case' 0 N--CA 1.483 1.204 0 C-N-CA 123.851 0.861 . . . . 73.109999999999999 110.218 172.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.506 ' HB2' HG23 ' A' ' 50' ' ' ILE . 21.8 mt -78.58 -34.95 46.5 Favored 'General case' 0 CA--C 1.549 0.933 0 CA-C-N 114.312 -1.313 . . . . 64.219999999999999 110.194 -172.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 78.5 mt -62.88 -47.43 92.85 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.069 0 C-N-CA 123.86 0.864 . . . . 71.140000000000001 110.619 176.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -66.29 -15.63 63.37 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 112.823 0.675 . . . . 62.039999999999999 112.823 178.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 19.9 m80 -87.64 -8.86 55.65 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 122.726 0.411 . . . . 71.549999999999997 111.955 173.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . . . . . . . . . 40.1 t -130.39 102.18 6.07 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.579 0.752 . . . . 75.439999999999998 109.175 179.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -58.49 -28.37 65.33 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.106 0.562 . . . . 65.239999999999995 110.627 176.33 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.631 HD11 HD12 ' A' ' 105' ' ' LEU . 40.2 tp -62.35 -48.06 81.48 Favored 'General case' 0 C--N 1.351 0.654 0 O-C-N 123.501 0.501 . . . . 73.450000000000003 110.358 174.549 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -58.81 -45.33 90.18 Favored 'General case' 0 C--N 1.355 0.809 0 O-C-N 124.075 0.859 . . . . 75.109999999999999 110.075 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -57.74 -44.31 85.98 Favored 'General case' 0 CA--C 1.541 0.6 0 O-C-N 124.357 1.036 . . . . 71.120000000000005 111.018 178.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.448 ' HB3' HD22 ' A' ' 104' ' ' LEU . 17.8 mm100 -68.31 -36.32 79.15 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.339 0.656 . . . . 63.009999999999998 112.308 179.657 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 93.3 mt -67.77 -46.79 81.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 123.077 0.551 . . . . 72.430000000000007 109.984 179.433 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -71.4 -21.73 61.96 Favored 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 123.272 0.629 . . . . 63.409999999999997 111.694 176.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 57.4 tp -78.11 -53.1 7.76 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.265 0.626 . . . . 65.329999999999998 110.491 -179.544 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -84.95 -17.74 36.78 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.541 -0.754 . . . . 72.129999999999995 111.525 -174.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' CYS . . . . . 0.504 ' SG ' HG23 ' A' ' 97' ' ' ILE . 62.2 m -141.34 90.13 9.18 Favored Pre-proline 0 CA--C 1.553 1.086 0 C-N-CA 123.251 0.621 . . . . 55.310000000000002 109.602 177.363 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -75.31 -1.6 11.5 Favored 'Trans proline' 0 C--N 1.374 1.905 0 C-N-CA 122.784 2.323 . . . . 61.439999999999998 113.1 178.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -74.07 -22.58 77.68 Favored Glycine 0 C--N 1.351 1.388 0 N-CA-C 111.692 -0.563 . . . . 71.329999999999998 111.692 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 96.2 t -65.79 121.56 15.09 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 C-N-CA 123.74 0.816 . . . . 65.109999999999999 110.098 179.347 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -91.08 -40.34 11.67 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.334 1.054 . . . . 63.210000000000001 110.436 -176.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.2 t -154.18 160.52 41.91 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.595 0.712 . . . . 55.329999999999998 111.501 -175.159 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 48.4 mt -126.65 138.21 53.39 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.053 1.741 . . . . 75.239999999999995 106.803 174.07 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . 0.417 ' HB3' ' HB ' ' A' ' 85' ' ' THR . 49.9 ttm -116.66 104.63 11.57 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 108.311 -0.996 . . . . 51.310000000000002 108.311 172.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ILE . . . . . 0.772 HD13 HD13 ' A' ' 84' ' ' LEU . 10.6 mm -84.01 112.37 21.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 N-CA-C 107.778 -1.193 . . . . 73.040000000000006 107.778 -179.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -96.95 -158.2 31.19 Favored Glycine 0 C--O 1.242 0.627 0 N-CA-C 111.754 -0.538 . . . . 61.399999999999999 111.754 177.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -69.56 -62.1 1.52 Allowed 'General case' 0 C--O 1.244 0.77 0 C-N-CA 123.796 0.838 . . . . 70.25 109.301 174.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -98.87 -29.81 12.75 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-N 113.858 -1.519 . . . . 74.340000000000003 111.05 -174.709 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -114.64 173.19 6.59 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-N 115.275 -0.875 . . . . 72.549999999999997 113.182 -160.418 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LEU . . . . . 0.772 HD13 HD13 ' A' ' 79' ' ' ILE . 14.7 tp -144.79 117.4 8.62 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 125.576 1.55 . . . . 74.040000000000006 107.719 175.356 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.417 ' HB ' ' HB3' ' A' ' 78' ' ' MET . 11.3 m -103.62 109.52 21.24 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 108.914 -0.773 . . . . 60.229999999999997 108.914 -175.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.587 HG13 HD13 ' A' ' 101' ' ' ILE . 18.6 mm -88.46 117.28 31.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 108.708 -0.849 . . . . 62.140000000000001 108.708 -176.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . . . . . . . . . 1.7 m-20 -101.96 128.74 48.24 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 107.79 -1.189 . . . . 71.120000000000005 107.79 174.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -137.83 169.91 16.96 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.659 0.384 . . . . 51.219999999999999 110.389 179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.18 126.81 28.62 Favored 'General case' 0 C--N 1.35 0.609 0 N-CA-C 109.236 -0.654 . . . . 55.340000000000003 109.236 178.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ARG . . . . . . . . . . . . . 11.6 ptm85 -65.41 -23.17 66.88 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.475 0.917 . . . . 75.519999999999996 113.475 -169.052 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' MET . . . . . . . . . . . . . 22.6 mmt -79.19 -21.49 46.29 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.921 0.488 . . . . 74.239999999999995 110.937 179.706 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 9.0 t -88.02 145.57 7.32 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.377 0 N-CA-C 108.08 -1.082 . . . . 74.439999999999998 108.08 174.442 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 50.0 m-70 -106.95 144.06 34.14 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 112.895 0.702 . . . . 73.409999999999997 112.895 -167.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.3 m95 -61.72 -22.99 65.84 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 124.543 1.137 . . . . 65.439999999999998 112.199 174.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -53.42 -32.9 51.79 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.397 1.079 . . . . 74.340000000000003 112.119 -178.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 22.7 t -103.45 -20.79 13.93 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 123.859 0.864 . . . . 74.530000000000001 111.579 -179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ILE . . . . . 0.504 HG23 ' SG ' ' A' ' 71' ' ' CYS . 55.5 mt -97.48 -53.65 7.8 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 C-N-CA 122.886 0.474 . . . . 71.310000000000002 111.344 -170.259 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.45 ' HG3' ' CZ ' ' A' ' 32' ' ' PHE . 3.8 ttpm? -52.48 -47.77 92.3 Favored Pre-proline 0 N--CA 1.49 1.565 0 N-CA-C 114.026 1.121 . . . . 75.230000000000004 114.026 -173.053 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -55.33 -40.98 82.71 Favored 'Trans proline' 0 C--N 1.394 2.972 0 C-N-CA 122.121 1.881 . . . . 71.510000000000005 112.205 177.282 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLU . . . . . 0.45 ' O ' ' HG ' ' A' ' 104' ' ' LEU . 11.2 mm-40 -69.58 -38.05 77.19 Favored 'General case' 0 CA--C 1.542 0.669 0 CA-C-N 115.483 -0.781 . . . . 70.340000000000003 110.36 -177.515 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.587 HD13 HG13 ' A' ' 86' ' ' ILE . 86.2 mt -60.1 -52.28 63.1 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 C-N-CA 123.31 0.644 . . . . 70.120000000000005 110.322 176.731 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ILE . . . . . . . . . . . . . 79.6 mt -56.91 -39.24 63.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.993 0 C-N-CA 123.462 0.705 . . . . 42.109999999999999 111.026 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -64.25 -42.35 96.54 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.147 0.979 . . . . 71.519999999999996 111.33 178.063 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.524 HD23 ' HE2' ' A' ' 107' ' ' LYS . 89.6 mt -64.7 -43.67 92.74 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 123.497 0.719 . . . . 72.140000000000001 110.765 176.71 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.631 HD12 HD11 ' A' ' 63' ' ' LEU . 11.0 mp -66.88 -24.9 66.17 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 123.728 0.811 . . . . 71.099999999999994 111.164 178.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.488 HG23 ' H ' ' A' ' 17' ' ' ILE . 82.9 m -77.39 -48.93 16.0 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.448 0.699 . . . . 65.519999999999996 110.42 178.439 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.524 ' HE2' HD23 ' A' ' 104' ' ' LEU . 0.1 OUTLIER -68.14 -40.36 82.47 Favored 'General case' 0 C--N 1.358 0.968 0 O-C-N 123.337 0.398 . . . . 72.519999999999996 110.969 -174.16 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' GLN . . . . . 0.621 ' NE2' ' HB2' ' A' ' 63' ' ' LEU . 20.7 tt0 -55.84 -58.71 6.73 Favored 'General case' 0 C--N 1.358 0.938 0 O-C-N 123.916 0.76 . . . . 65.420000000000002 110.35 177.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 86.8 mt -71.64 -10.8 60.31 Favored 'General case' 0 CA--C 1.55 0.955 0 CA-C-N 114.841 -1.072 . . . . 72.439999999999998 111.764 -173.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -71.71 -37.1 70.69 Favored 'General case' 0 C--N 1.354 0.801 0 C-N-CA 123.269 0.628 . . . . 72.010000000000005 111.173 177.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 5.7 p90 -110.39 -19.14 13.06 Favored 'General case' 0 N--CA 1.495 1.785 0 C-N-CA 123.143 0.577 . . . . 52.210000000000001 111.953 178.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -119.8 163.11 13.8 Favored Glycine 0 C--N 1.339 0.729 0 N-CA-C 111.016 -0.834 . . . . 54.210000000000001 111.016 -176.873 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 3.2 mp0 -102.88 -24.19 13.7 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.356 0.662 . . . . 73.010000000000005 110.168 179.072 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 -114.27 158.84 20.87 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.787 0.835 . . . . 75.200000000000003 111.474 -167.779 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' VAL . . . . . 0.53 HG13 HG13 ' A' ' 116' ' ' ILE . 5.8 p -83.14 -44.15 18.64 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 123.891 0.877 . . . . 74.129999999999995 111.123 174.829 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.533 HD11 HG13 ' A' ' 79' ' ' ILE . 68.6 mt -112.49 -32.01 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.327 0 C-N-CA 124.128 0.971 . . . . 61.219999999999999 110.24 -177.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 68.7 m 68.61 45.04 1.12 Allowed 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 124.363 1.065 . . . . 73.450000000000003 109.057 -164.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' LYS . . . . . . . . . . . . . 5.1 tmtm? -78.73 83.75 4.86 Favored 'General case' 0 CA--C 1.551 1.008 0 CA-C-N 113.831 -1.531 . . . . 71.230000000000004 107.876 -179.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 . . . . . 0 CA--C 1.561 1.37 0 C-N-CA 125.002 1.321 . . . . 75.040000000000006 111.783 -176.512 . . . . . . . . 0 0 . 1 stop_ save_