data_2mti_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 2mti _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.433 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 6.0 mp . . . . . 0 C--O 1.222 -0.372 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -79.49 143.38 34.96 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -174.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.652 ' SG ' ' HD2' ' A' ' 7' ' ' PRO . 49.0 t -137.37 156.2 75.27 Favored Pre-proline 0 C--N 1.306 -1.293 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.652 ' HD2' ' SG ' ' A' ' 6' ' ' CYS . 81.7 Cg_exo -48.78 153.22 3.79 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 122.843 2.362 . . . . 0.0 112.814 176.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -59.95 -29.37 68.37 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -171.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -78.43 -10.84 59.86 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.295 0.569 . . . . 0.0 111.226 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.471 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 26.9 m95 -95.63 117.03 29.71 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.041 -173.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -72.72 122.04 20.83 Favored 'General case' 0 CA--C 1.497 -1.066 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -176.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.0 p -92.7 128.52 38.58 Favored 'General case' 0 N--CA 1.41 -2.428 0 CA-C-O 122.355 1.074 . . . . 0.0 113.556 -174.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 25.5 t60 -138.41 154.78 48.9 Favored 'General case' 0 C--O 1.2 -1.531 0 C-N-CA 126.973 2.109 . . . . 0.0 105.839 -177.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -11.89 83.98 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.998 0 C-N-CA 125.78 1.632 . . . . 0.0 114.586 175.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.43 ' C ' ' HG3' ' A' ' 16' ' ' LYS . 18.9 m-20 60.74 23.53 13.42 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.801 1.641 . . . . 0.0 114.617 173.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.596 ' HE2' ' OE1' ' A' ' 49' ' ' GLU . 13.0 mtpp -148.86 142.58 25.56 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.849 ' SG ' ' HB3' ' A' ' 124' ' ' LYS . 19.4 p -123.9 139.28 54.11 Favored 'General case' 0 C--N 1.287 -2.116 0 O-C-N 121.511 -0.743 . . . . 0.0 109.807 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.412 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 17.5 m-85 -116.87 140.51 49.37 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -171.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -115.56 106.64 14.16 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.1 t -87.42 92.47 3.81 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.751 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.1 m -77.26 114.56 16.2 Favored 'General case' 0 N--CA 1.423 -1.804 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.354 -176.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.542 ' C ' ' HG2' ' A' ' 119' ' ' ARG . 9.2 mm100 -83.86 13.92 4.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.755 0.822 . . . . 0.0 112.663 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.467 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.8 m -109.63 150.09 12.43 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 178.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.0 m -98.24 152.8 19.01 Favored 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -173.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.9 m-20 -154.43 -176.92 6.12 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 127.506 2.322 . . . . 0.0 106.687 178.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 61.3 p -91.81 168.34 11.52 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 168.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 92.0 t90 -58.35 -53.83 53.87 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.593 0.633 . . . . 0.0 112.289 -175.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.482 ' O ' HG21 ' A' ' 32' ' ' VAL . 42.9 mt-10 -64.93 -31.93 73.41 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.307 0.575 . . . . 0.0 110.416 -177.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -71.45 -42.15 68.56 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.124 -0.943 . . . . 0.0 110.594 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.57 -33.88 87.51 Favored Glycine 0 CA--C 1.501 -0.843 0 N-CA-C 110.859 -0.896 . . . . 0.0 110.859 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 tt -59.91 -46.86 88.01 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 176.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.482 HG21 ' O ' ' A' ' 28' ' ' GLU . 90.1 t -61.87 -36.68 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.274 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -61.26 -36.76 80.9 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.845 175.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.0 m -71.51 -40.07 70.38 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -55.98 -39.7 72.2 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -56.17 -34.41 62.54 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 114.943 -1.026 . . . . 0.0 114.434 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -89.76 -5.3 57.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.51 0.655 . . . . 0.0 111.507 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.06 51.91 5.98 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 107.753 -2.139 . . . . 0.0 107.753 -171.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.01 178.04 8.5 Favored 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.2 p -123.14 158.48 30.62 Favored 'General case' 0 C--N 1.281 -2.409 0 C-N-CA 122.765 0.426 . . . . 0.0 110.936 -177.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.1 tp -76.15 130.48 38.33 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 174.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.2 tpt -30.03 120.53 0.17 Allowed 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 117.264 2.32 . . . . 0.0 117.264 -169.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -109.1 110.95 22.32 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 124.704 1.201 . . . . 0.0 108.007 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.482 ' HB ' ' CH2' ' A' ' 79' ' ' TRP . 37.8 mt -98.68 132.84 43.1 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -175.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -105.84 -44.27 4.67 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 120.868 0.365 . . . . 0.0 111.464 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -137.57 178.13 7.34 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -172.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -81.04 -19.42 43.88 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 122.049 -0.407 . . . . 0.0 110.362 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 51.9 mt-10 -57.91 -33.23 68.54 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.699 0.762 . . . . 0.0 109.788 173.495 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.596 ' OE1' ' HE2' ' A' ' 16' ' ' LYS . 10.2 mm-40 -64.89 -55.36 19.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.671 -1.15 . . . . 0.0 107.995 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.506 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 63.4 mt -68.96 -25.15 64.4 Favored 'General case' 0 CA--C 1.496 -1.13 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -176.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 34.7 ptt180 -68.93 -33.73 74.21 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.363 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -73.72 -28.21 61.59 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.666 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.4 mm? -63.75 -48.83 75.4 Favored 'General case' 0 C--O 1.176 -2.805 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 43.7 mt -54.76 -34.11 62.15 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -67.35 -46.74 72.51 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.953 0.406 . . . . 0.0 111.444 172.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.8 p -81.17 -20.88 40.27 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -174.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.666 HG12 ' O ' ' A' ' 53' ' ' LEU . 16.6 mm -56.24 -45.97 81.27 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 C-N-CA 123.817 0.847 . . . . 0.0 111.031 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? 69.86 -63.69 0.38 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.024 0.929 . . . . 0.0 112.798 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.87 -56.34 6.5 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -175.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.424 ' C ' ' H ' ' A' ' 62' ' ' ASN . 91.4 mttt 74.06 -38.57 0.4 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.175 0.99 . . . . 0.0 113.669 -176.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -82.3 28.85 0.44 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.879 0.847 . . . . 0.0 111.707 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.424 ' H ' ' C ' ' A' ' 60' ' ' LYS . 53.4 m-80 -132.6 -173.99 3.33 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.026 177.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.596 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 13.3 m -137.63 133.09 33.93 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.469 ' HA ' ' O ' ' A' ' 119' ' ' ARG . 1.0 OUTLIER -131.47 118.62 20.44 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -175.556 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -59.99 135.95 57.87 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 123.357 0.663 . . . . 0.0 112.038 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.59 176.21 2.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 N-CA-C 106.6 -1.629 . . . . 0.0 106.6 169.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.532 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.28 40.44 1.73 Allowed Glycine 0 C--O 1.22 -0.763 0 CA-C-N 118.89 0.768 . . . . 0.0 114.59 -174.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.56 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 20.5 mt -101.93 115.51 30.7 Favored 'General case' 0 CA--C 1.488 -1.422 0 C-N-CA 123.191 0.596 . . . . 0.0 111.637 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 28.4 ptt180 -122.02 137.22 54.88 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.104 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -91.11 113.69 26.02 Favored 'General case' 0 C--N 1.287 -2.137 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.7 p . . . . . 0 C--N 1.301 -1.514 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -174.129 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 16.3 m120 . . . . . 0 CA--C 1.492 -1.278 0 CA-C-O 121.047 0.451 . . . . 0.0 110.052 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -88.92 125.72 35.07 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.371 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -118.9 158.84 24.91 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.121 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.56 ' CZ3' ' HG ' ' A' ' 68' ' ' LEU . 62.4 m95 -96.19 176.32 6.12 Favored 'General case' 0 C--N 1.277 -2.572 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.4 pt -73.36 -23.34 19.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 CA-C-O 121.01 0.433 . . . . 0.0 111.362 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.441 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 29.6 p-10 -83.3 -16.32 46.68 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.3 8.49 35.64 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.435 -0.802 . . . . 0.0 113.081 175.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.8 m -75.65 170.52 16.01 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 175.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 20.7 m -102.54 139.68 37.82 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.0 tp -62.98 142.36 58.39 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 176.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -95.7 86.8 4.5 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.6 p -71.09 -8.23 52.02 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -176.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -77.94 -14.12 59.64 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 27.7 m -75.76 -49.66 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.828 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.0 mt -147.69 -179.01 6.57 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 -173.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 99.87 1.74 Allowed 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 8.0 mt -140.51 96.67 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 172.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.3 m -62.24 124.67 21.48 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.884 -178.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -85.69 -41.49 7.24 Favored Glycine 0 N--CA 1.41 -3.059 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -94.29 88.37 5.54 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-O 121.82 0.819 . . . . 0.0 110.971 178.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.8 t -126.39 -32.43 2.68 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.536 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 60.83 36.99 18.91 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.303 0.641 . . . . 0.0 111.383 176.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.409 ' C ' ' H ' ' A' ' 100' ' ' SER . 40.7 m-80 -116.99 177.82 4.57 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -81.58 27.69 0.43 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 126.167 1.787 . . . . 0.0 109.372 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.409 ' H ' ' C ' ' A' ' 98' ' ' ASN . 13.9 m -72.85 142.62 47.97 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -170.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 61.6 m -133.06 146.28 51.54 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 103.944 -2.613 . . . . 0.0 103.944 166.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -99.81 153.14 19.37 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -172.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.29 148.43 36.33 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.61 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.596 ' O ' ' HA ' ' A' ' 63' ' ' SER . 11.0 mm -78.13 128.4 38.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.483 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 175.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.1 t -140.42 90.17 2.34 Favored 'General case' 0 N--CA 1.408 -2.529 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 89.0 -126.65 8.3 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.25 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -101.86 8.55 41.23 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 176.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -119.13 167.21 12.02 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.814 -175.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 14.2 t -115.75 134.24 59.63 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 N-CA-C 104.682 -2.34 . . . . 0.0 104.682 173.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 69.7 p -124.97 170.07 11.48 Favored 'General case' 0 C--N 1.267 -2.988 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 25.4 p90 -148.46 142.04 25.45 Favored 'General case' 0 C--N 1.298 -1.666 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.421 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -154.69 178.69 9.83 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.815 -176.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.3 m -54.07 124.53 15.9 Favored 'General case' 0 N--CA 1.443 -0.817 0 O-C-N 124.132 0.895 . . . . 0.0 108.992 176.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 8.4 m -53.57 -22.88 9.27 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.491 1.117 . . . . 0.0 112.635 -174.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -80.43 -2.06 44.15 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 24.9 p -74.47 136.58 42.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 119.236 0.925 . . . . 0.0 112.608 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.79 101.42 0.26 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.328 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' ASN . . . . . 0.52 ' OD1' ' HB2' ' A' ' 63' ' ' SER . 47.3 m-80 -142.58 158.98 43.1 Favored 'General case' 0 CA--C 1.485 -1.539 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.209 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.751 ' HB3' ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.57 178.68 6.49 Favored 'General case' 0 C--N 1.292 -1.925 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.093 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 18.4 p90 -152.36 167.14 29.65 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 118.733 -1.187 . . . . 0.0 112.36 -174.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 82.6 mt -125.29 118.28 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 CA-C-O 121.625 0.726 . . . . 0.0 110.712 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 90.7 m -97.02 140.87 30.89 Favored 'General case' 0 C--N 1.287 -2.135 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.758 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.466 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 5.0 pt20 -120.12 137.86 53.91 Favored 'General case' 0 N--CA 1.415 -2.213 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 173.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.849 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 22.8 ttmm -110.95 110.91 21.69 Favored 'General case' 0 C--N 1.258 -3.374 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 171.113 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -83.54 124.0 30.31 Favored 'General case' 0 N--CA 1.406 -2.63 0 C-N-CA 119.621 -0.832 . . . . 0.0 108.767 -175.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.433 ' HG ' ' H ' ' A' ' 4' ' ' LEU . 1.8 mm? . . . . . 0 C--N 1.316 -0.852 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.255 -177.117 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.419 ' N ' HD13 ' A' ' 4' ' ' LEU . 4.7 mp . . . . . 0 N--CA 1.44 -0.936 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -94.38 135.05 36.24 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.577 -176.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.405 ' HB3' HD11 ' A' ' 126' ' ' LEU . 8.8 p -128.58 166.41 24.76 Favored Pre-proline 0 C--N 1.296 -1.738 0 C-N-CA 124.089 0.956 . . . . 0.0 108.501 177.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -61.42 156.91 43.66 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 121.641 1.561 . . . . 0.0 113.155 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -42.64 -48.64 5.51 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 116.299 1.963 . . . . 0.0 116.299 -175.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -83.76 7.15 18.68 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -172.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 60.1 m95 -104.4 121.45 43.42 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 121.232 0.539 . . . . 0.0 110.711 -177.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.503 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 4.8 mp -75.92 106.51 7.54 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 124.843 1.257 . . . . 0.0 111.063 -176.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.1 p -74.66 114.44 13.08 Favored 'General case' 0 C--N 1.276 -2.625 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.794 -176.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -138.93 125.72 20.9 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 123.999 0.919 . . . . 0.0 109.413 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 57.93 -88.61 0.02 OUTLIER 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -178.623 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -144.69 25.31 1.48 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.499 0.666 . . . . 0.0 110.112 -177.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.36 151.7 36.96 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 178.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.596 ' SG ' HD23 ' A' ' 126' ' ' LEU . 80.8 m -116.34 140.36 49.42 Favored 'General case' 0 C--N 1.275 -2.631 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -110.82 141.67 43.86 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -119.24 108.17 14.31 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 173.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.0 t -89.18 95.05 5.13 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.68 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.8 m -77.97 115.19 17.52 Favored 'General case' 0 N--CA 1.417 -2.085 0 CA-C-N 115.328 -0.851 . . . . 0.0 108.725 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.547 HE22 ' ND2' ' A' ' 62' ' ' ASN . 12.0 mm100 -87.82 13.75 10.08 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.956 0.902 . . . . 0.0 111.255 -178.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.8 m -107.65 156.48 8.12 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 37.7 m -91.77 156.74 17.33 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -173.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.1 m-20 -170.88 170.75 6.28 Favored 'General case' 0 CA--C 1.502 -0.876 0 C-N-CA 127.414 2.286 . . . . 0.0 107.912 175.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.5 p -85.02 166.02 17.06 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 172.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.468 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 88.9 t90 -56.48 -53.26 59.54 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -174.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.436 ' O ' HG22 ' A' ' 32' ' ' VAL . 37.9 mt-10 -63.92 -32.29 73.77 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.942 0.877 . . . . 0.0 110.556 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -73.91 -44.28 55.68 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.46 -1.245 . . . . 0.0 110.412 -175.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.12 -34.63 90.49 Favored Glycine 0 C--O 1.221 -0.682 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 174.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 tt -58.86 -51.17 71.14 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.436 HG22 ' O ' ' A' ' 28' ' ' GLU . 87.6 t -59.3 -38.21 73.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.502 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.89 -36.64 84.59 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.98 -0.555 . . . . 0.0 112.103 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 81.3 m -66.34 -43.47 86.02 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -57.23 -29.88 64.13 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.577 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -56.92 -34.91 66.33 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.933 179.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -101.44 11.57 38.89 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.78 14.07 82.93 Favored Glycine 0 C--O 1.245 0.794 0 CA-C-O 121.625 0.57 . . . . 0.0 111.763 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -104.69 166.16 10.58 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -175.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.2 p -110.01 160.57 16.32 Favored 'General case' 0 C--N 1.28 -2.441 0 O-C-N 122.175 -0.328 . . . . 0.0 110.626 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -75.52 124.69 27.61 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.3 tpt -24.72 120.09 0.05 Allowed 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 -170.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -110.55 105.45 14.39 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 124.845 1.258 . . . . 0.0 107.62 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.451 HD13 HD11 ' A' ' 50' ' ' LEU . 34.2 mt -86.22 105.81 15.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -176.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -90.27 -22.69 21.47 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.731 -176.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.509 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 15.9 t70 -149.64 163.9 36.63 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -170.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -35.22 80.32 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 176.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -60.56 -27.83 67.97 Favored 'General case' 0 CA--C 1.499 -0.983 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.509 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 13.3 mm-40 -57.54 -55.79 30.26 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.644 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 61.6 mt -71.88 -25.78 62.07 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -177.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -62.88 -38.01 89.2 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -68.06 -37.0 80.79 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.679 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.5 mm? -62.48 -53.17 58.81 Favored 'General case' 0 C--O 1.206 -1.193 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 60.3 mt -56.49 -34.59 67.1 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -177.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -73.56 -41.91 62.32 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 176.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.3 p -81.4 -34.98 31.26 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.679 HG12 ' O ' ' A' ' 53' ' ' LEU . 51.0 mm -57.12 -45.73 84.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 CA-C-O 121.244 0.545 . . . . 0.0 109.655 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 52.0 tptt 68.96 -56.79 0.53 Allowed 'General case' 0 C--O 1.24 0.588 0 C-N-CA 124.895 1.278 . . . . 0.0 112.858 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -62.26 -52.18 64.75 Favored 'General case' 0 C--O 1.207 -1.156 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.48 ' C ' ' H ' ' A' ' 62' ' ' ASN . 97.6 mttt 73.86 -47.98 0.66 Allowed 'General case' 0 C--O 1.205 -1.27 0 C-N-CA 124.98 1.312 . . . . 0.0 112.712 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -70.21 27.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.168 1.387 . . . . 0.0 114.058 -174.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.547 ' ND2' HE22 ' A' ' 22' ' ' GLN . 77.6 m-20 -115.29 -171.18 1.91 Allowed 'General case' 0 C--N 1.286 -2.186 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 176.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.652 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 14.0 m -144.82 119.3 9.67 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.517 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.5 m-85 -124.33 123.47 40.27 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -176.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.519 ' CE2' ' HB2' ' A' ' 118' ' ' ASN . 78.0 m95 -62.17 138.86 58.47 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 123.182 0.593 . . . . 0.0 110.616 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -118.45 174.67 4.11 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 169.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.599 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.41 47.52 2.39 Favored Glycine 0 C--O 1.21 -1.386 0 CA-C-N 118.728 0.695 . . . . 0.0 114.817 -173.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.495 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 17.3 mt -113.4 120.01 39.61 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 123.451 0.701 . . . . 0.0 111.901 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -126.4 140.38 52.53 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.291 176.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -91.06 124.5 35.34 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.5 p . . . . . 0 C--N 1.3 -1.572 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -175.397 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.9 m120 . . . . . 0 C--O 1.258 1.509 0 CA-C-O 121.097 0.475 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 66.8 m95 -97.41 134.41 40.71 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -126.79 151.97 47.55 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.683 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.599 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 37.0 m95 -93.63 169.93 9.96 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 38.6 pt -69.38 -20.42 24.13 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -177.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.439 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 31.3 p-10 -85.05 -14.14 48.24 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.655 0.741 . . . . 0.0 109.286 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.98 8.41 36.55 Favored Glycine 0 N--CA 1.443 -0.894 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.363 176.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.8 m -74.97 163.42 27.64 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.032 0.444 . . . . 0.0 111.692 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 19.9 m -98.96 140.4 33.16 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 176.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.442 HD11 HD12 ' A' ' 92' ' ' ILE . 43.5 tp -54.64 143.86 23.57 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -100.87 95.73 6.82 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 170.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.0 m -71.39 -11.28 60.81 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.123 0.487 . . . . 0.0 111.814 -175.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -78.14 -12.49 60.0 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -176.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 29.2 m -75.3 -54.2 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 C-N-CA 119.079 -1.048 . . . . 0.0 112.473 -177.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.5 mt -152.03 -178.29 6.68 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -177.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -68.33 111.88 4.87 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -176.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.442 HD12 HD11 ' A' ' 85' ' ' LEU . 9.7 mt -145.97 105.44 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 174.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.0 m -61.06 128.99 39.16 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 123.021 0.529 . . . . 0.0 109.899 -179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -84.33 -53.33 3.3 Favored Glycine 0 N--CA 1.418 -2.516 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 -176.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -93.23 82.56 4.53 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-O 122.767 1.27 . . . . 0.0 110.536 176.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.6 t -100.69 -24.01 14.51 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.587 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 63.46 17.63 10.47 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.609 0.764 . . . . 0.0 112.218 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -111.32 -178.68 3.51 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -86.67 26.93 1.03 Allowed 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 126.654 1.982 . . . . 0.0 109.798 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 m -72.1 150.72 43.63 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 116.619 2.081 . . . . 0.0 116.619 -170.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -143.45 148.78 36.63 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 166.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -98.09 153.81 18.17 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -169.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.25 150.2 38.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.376 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.652 ' O ' ' HA ' ' A' ' 63' ' ' SER . 17.5 mm -77.82 112.11 15.41 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.532 0 N-CA-C 106.627 -1.619 . . . . 0.0 106.627 173.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.531 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 8.8 t -134.04 100.6 4.77 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 98.62 -134.43 11.69 Favored Glycine 0 C--N 1.276 -2.79 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -100.15 0.98 41.63 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -128.77 -176.66 3.91 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.315 -172.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.2 t -105.88 135.41 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.548 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 71.2 p -131.32 175.08 9.43 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 106.406 -1.701 . . . . 0.0 106.406 176.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -146.5 156.91 43.61 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 119.94 1.245 . . . . 0.0 113.307 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -161.3 -176.38 5.37 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.362 1.065 . . . . 0.0 109.67 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 17.5 t -68.66 128.38 36.42 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 176.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 79.5 m -50.62 -12.93 0.11 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 126.045 1.738 . . . . 0.0 115.202 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -100.97 3.66 41.81 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.279 -168.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.5 p -85.81 172.65 10.62 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 121.593 0.711 . . . . 0.0 111.522 177.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.54 123.07 26.68 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.227 175.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' ASN . . . . . 0.519 ' HB2' ' CE2' ' A' ' 65' ' ' TRP . 74.5 m-20 -158.88 172.73 17.68 Favored 'General case' 0 CA--C 1.488 -1.439 0 C-N-CA 125.092 1.357 . . . . 0.0 107.421 172.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.68 ' HB3' ' O ' ' A' ' 21' ' ' SER . 2.2 mpt_? -100.96 -169.92 1.77 Allowed 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 178.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 16.0 p90 -154.41 160.99 41.95 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.663 1.574 . . . . 0.0 112.573 -177.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 75.3 mt -120.83 125.54 74.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.941 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 72.2 m -106.17 146.9 29.66 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.109 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -123.77 133.91 53.75 Favored 'General case' 0 N--CA 1.425 -1.718 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 173.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.7 tttm -109.81 109.21 19.8 Favored 'General case' 0 C--N 1.272 -2.763 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.35 124.23 28.68 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 121.353 0.597 . . . . 0.0 110.69 -172.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.596 HD23 ' SG ' ' A' ' 17' ' ' CYS . 2.9 mm? . . . . . 0 C--N 1.312 -1.05 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.091 -178.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.448 ' CD1' ' HB3' ' A' ' 126' ' ' LEU . 4.8 mp . . . . . 0 CA--C 1.545 0.764 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -87.37 147.44 25.47 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -177.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.531 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 65.0 m -113.45 164.36 15.97 Favored Pre-proline 0 C--N 1.301 -1.508 0 CA-C-N 113.759 -1.564 . . . . 0.0 110.591 -177.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.29 164.06 18.59 Favored 'Trans proline' 0 C--N 1.367 1.501 0 C-N-CA 122.2 1.934 . . . . 0.0 112.377 175.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -53.98 -35.66 62.06 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -174.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.55 4.76 50.31 Favored 'General case' 0 C--N 1.317 -0.809 0 O-C-N 121.986 -0.446 . . . . 0.0 111.418 -175.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 24.9 m95 -112.89 145.93 39.85 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 120.821 0.343 . . . . 0.0 110.973 -174.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.1 mm? -100.62 178.83 4.6 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 105.271 -2.122 . . . . 0.0 105.271 173.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.531 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 56.1 p -155.89 148.81 24.25 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 119.525 1.057 . . . . 0.0 113.334 179.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 29.2 t-80 -154.37 135.96 14.32 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 67.83 -70.87 0.11 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.625 1.17 . . . . 0.0 113.828 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . 0.457 ' C ' ' HD3' ' A' ' 16' ' ' LYS . 9.4 p-10 -167.31 24.69 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.839 -174.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.457 ' HD3' ' C ' ' A' ' 15' ' ' ASP . 3.9 mppt? -144.5 143.8 31.03 Favored 'General case' 0 CA--C 1.511 -0.547 0 C-N-CA 122.834 0.454 . . . . 0.0 110.358 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 123' ' ' GLN . 15.2 m -97.1 151.36 19.84 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 174.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -130.77 134.04 46.52 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 118.486 0.585 . . . . 0.0 110.046 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -119.76 108.94 15.02 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.6 t -83.87 93.79 3.29 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.764 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.5 m -77.67 110.8 12.81 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.243 -177.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -83.44 14.35 3.75 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.889 0.876 . . . . 0.0 112.962 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.54 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 6.7 m -107.14 153.55 8.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.7 m -108.83 143.96 37.32 Favored 'General case' 0 C--N 1.3 -1.543 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -173.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -154.3 172.98 16.8 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 126.476 1.91 . . . . 0.0 108.994 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.4 p -77.86 166.68 22.61 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 171.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 t90 -56.56 -50.96 70.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.337 0.589 . . . . 0.0 111.477 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.439 ' H ' ' CD ' ' A' ' 28' ' ' GLU . 0.1 OUTLIER -65.92 -35.95 82.04 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.993 -176.615 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -66.3 -45.06 81.69 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.832 -179.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.65 -32.24 82.76 Favored Glycine 0 N--CA 1.465 0.594 0 C-N-CA 121.39 -0.434 . . . . 0.0 112.388 176.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tt -61.28 -51.52 68.56 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 58.8 t -61.92 -32.08 53.1 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.331 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.538 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 0.9 OUTLIER -61.65 -45.3 94.64 Favored 'General case' 0 CA--C 1.501 -0.935 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.853 174.835 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 60.5 m -64.25 -41.92 96.74 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -56.69 -38.05 71.74 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 123.793 0.683 . . . . 0.0 109.637 176.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.26 -23.15 61.8 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 114.913 -1.039 . . . . 0.0 114.036 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.538 ' HD2' ' O ' ' A' ' 33' ' ' ASP . 2.1 mptp? -97.27 2.73 51.14 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 117.915 0.857 . . . . 0.0 110.711 177.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.93 50.01 25.68 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 108.499 -1.84 . . . . 0.0 108.499 -173.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 123' ' ' GLN . . . -147.82 176.77 9.87 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.6 p -116.14 164.86 13.86 Favored 'General case' 0 C--N 1.292 -1.917 0 C-N-CA 122.798 0.439 . . . . 0.0 110.684 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.0 tp -80.96 127.95 33.14 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 105.936 -1.876 . . . . 0.0 105.936 174.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.3 tpt -28.73 122.4 0.12 Allowed 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 -169.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -114.68 108.86 17.36 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.345 1.458 . . . . 0.0 107.387 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 52.9 mt -88.88 110.57 21.54 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.152 0.501 . . . . 0.0 111.512 -173.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -79.97 -32.32 39.85 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.794 -177.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -158.59 169.33 24.66 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -34.34 76.54 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 123.496 0.718 . . . . 0.0 109.62 178.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 12.0 pt-20 -58.38 -27.31 64.12 Favored 'General case' 0 C--O 1.243 0.723 0 C-N-CA 122.886 0.474 . . . . 0.0 111.363 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -66.92 -54.35 22.95 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.5 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 37.7 mt -66.65 -26.95 67.3 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 20.3 ptt180 -68.58 -32.02 71.64 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 119.331 -0.948 . . . . 0.0 109.363 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -74.26 -27.99 61.0 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.678 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -65.17 -48.15 74.48 Favored 'General case' 0 C--O 1.193 -1.906 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 46.3 mt -57.78 -33.43 68.52 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 123.412 0.445 . . . . 0.0 111.464 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.92 -41.76 97.57 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.551 175.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.3 p -88.27 -24.64 23.15 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -176.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.678 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.8 mm -56.33 -47.77 80.76 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 C-N-CA 123.603 0.761 . . . . 0.0 111.081 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 52.5 tptt 67.98 -69.65 0.14 Allowed 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.916 1.286 . . . . 0.0 113.696 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -65.55 -34.56 78.53 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.466 ' H ' HG23 ' A' ' 57' ' ' ILE . 49.4 mttp 72.98 -57.19 0.64 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.755 1.222 . . . . 0.0 112.354 177.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -68.74 6.55 0.83 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.168 1.387 . . . . 0.0 114.407 -170.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.579 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 51.2 m-80 -82.63 -168.49 2.04 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 173.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.446 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 8.3 m -140.22 114.51 9.19 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.579 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 4.9 m-85 -121.55 120.11 33.9 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.267 -177.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.412 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 55.0 m95 -62.81 137.59 58.31 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 123.067 0.547 . . . . 0.0 111.071 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.88 177.33 2.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 167.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.688 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.28 54.07 3.55 Favored Glycine 0 C--O 1.199 -2.07 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.382 -176.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 35.1 mt -126.52 118.28 24.58 Favored 'General case' 0 CA--C 1.489 -1.383 0 C-N-CA 123.55 0.74 . . . . 0.0 111.689 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -133.73 141.49 47.55 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 173.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.451 ' HE1' ' O ' ' A' ' 94' ' ' GLY . 59.1 t80 -86.14 112.59 21.45 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 104.26 -2.496 . . . . 0.0 104.26 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.274 -2.681 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -173.574 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 8.8 m120 . . . . . 0 CA--C 1.507 -0.689 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -95.27 111.46 23.31 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -114.38 147.65 38.86 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.102 -178.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.688 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 49.0 m95 -93.4 169.21 10.54 Favored 'General case' 0 N--CA 1.429 -1.522 0 CA-C-N 114.772 -1.103 . . . . 0.0 108.55 178.282 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.8 pt -71.83 -13.9 17.11 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.909 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.576 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 33.7 p-10 -89.84 -11.0 43.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.485 0.659 . . . . 0.0 109.402 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.12 1.05 44.84 Favored Glycine 0 CA--C 1.499 -0.918 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.155 174.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 57.2 m -80.04 165.77 22.21 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 122.834 0.454 . . . . 0.0 111.939 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.3 m -105.05 141.87 35.85 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 39.0 tp -56.91 140.21 49.21 Favored 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 124.98 1.312 . . . . 0.0 113.845 178.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -95.2 98.39 10.59 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 166.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.4 p -70.61 -8.68 53.48 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -175.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -78.44 -6.0 54.06 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 27.5 m -74.73 -48.22 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 C-N-CA 119.045 -1.062 . . . . 0.0 111.266 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.1 mt -153.78 177.56 10.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -177.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.89 109.51 2.11 Favored 'General case' 0 CA--C 1.499 -1.001 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 9.4 mt -146.66 106.3 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 171.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.7 m -63.97 122.26 16.07 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.451 ' O ' ' HE1' ' A' ' 70' ' ' TYR . . . -89.54 -19.53 48.43 Favored Glycine 0 N--CA 1.419 -2.445 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -174.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -122.3 104.84 9.7 Favored 'General case' 0 N--CA 1.422 -1.825 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 175.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' THR . . . . . 0.421 HG22 ' H ' ' A' ' 98' ' ' ASN . 12.3 t -141.36 -26.05 0.7 Allowed 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.4 -173.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 62.67 29.41 16.85 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.421 ' H ' HG22 ' A' ' 96' ' ' THR . 40.6 m-80 -122.53 143.84 49.47 Favored 'General case' 0 C--O 1.205 -1.282 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 175.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -82.55 27.32 0.52 Allowed 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 125.049 1.34 . . . . 0.0 110.622 -172.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.431 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 32.8 t -74.09 158.29 34.51 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 125.782 1.633 . . . . 0.0 112.276 -173.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 88.5 m -117.31 143.88 45.46 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -89.45 143.12 27.07 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-O 121.427 0.632 . . . . 0.0 112.154 -175.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -141.07 151.74 44.26 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.556 -178.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 63' ' ' SER . 13.9 mm -77.48 121.77 30.74 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 175.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 8.8 t -145.32 97.31 2.98 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.71 -119.83 6.66 Favored Glycine 0 C--N 1.283 -2.374 0 CA-C-N 114.317 -1.31 . . . . 0.0 110.186 179.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.51 ' OD2' ' HE2' ' A' ' 108' ' ' LYS . 6.5 p-10 -115.19 8.52 15.59 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 123.323 0.649 . . . . 0.0 109.249 177.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.51 ' HE2' ' OD2' ' A' ' 107' ' ' ASP . 74.4 mmtt -134.92 174.69 10.32 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.486 -176.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.3 t -101.39 130.65 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.031 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 175.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 59.1 p -131.6 141.83 49.75 Favored 'General case' 0 C--N 1.272 -2.788 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.431 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 6.8 p90 -99.79 133.1 44.64 Favored 'General case' 0 C--N 1.287 -2.115 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -177.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -121.1 165.75 14.89 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 114.427 -1.261 . . . . 0.0 107.622 -174.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 38.2 m -64.74 130.59 44.11 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 8.5 m -59.98 -19.64 53.35 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.417 0.627 . . . . 0.0 111.434 -175.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -93.38 4.39 54.04 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.255 1.022 . . . . 0.0 112.574 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.4 p -73.54 -7.95 53.96 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 13.8 t70 62.64 87.48 0.1 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.628 1.171 . . . . 0.0 110.392 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -127.81 175.07 8.61 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -177.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.764 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.2 mpt_? -83.43 -174.7 5.44 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 -177.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.441 ' CH2' HG23 ' A' ' 23' ' ' VAL . 26.9 p90 -156.58 172.72 18.08 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.659 1.118 . . . . 0.0 112.132 -177.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 85.5 mt -126.44 122.59 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-O 121.417 0.627 . . . . 0.0 110.128 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 74.3 m -100.12 143.72 29.99 Favored 'General case' 0 C--N 1.29 -2.022 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.56 ' O ' ' HB3' ' A' ' 39' ' ' ALA . 6.3 pt20 -121.54 154.06 37.18 Favored 'General case' 0 N--CA 1.417 -2.089 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 173.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -132.33 110.47 10.6 Favored 'General case' 0 C--N 1.268 -2.95 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 176.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.9 118.33 18.58 Favored 'General case' 0 C--N 1.282 -2.338 0 CA-C-O 121.648 0.737 . . . . 0.0 111.96 -177.304 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.448 ' HB3' ' CD1' ' A' ' 4' ' ' LEU . 2.6 mm? . . . . . 0 N--CA 1.435 -1.201 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.414 176.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.434 ' N ' HD13 ' A' ' 4' ' ' LEU . 2.2 mp . . . . . 0 CA--C 1.547 0.847 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -99.21 140.14 33.82 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.168 -1.013 . . . . 0.0 111.8 178.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.505 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 65.7 m -101.93 161.91 22.0 Favored Pre-proline 0 C--N 1.309 -1.179 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.665 -176.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.599 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 31.8 Cg_exo -61.81 156.37 48.93 Favored 'Trans proline' 0 CA--C 1.555 1.562 0 C-N-CA 121.612 1.541 . . . . 0.0 109.854 173.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -51.71 -33.66 35.34 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 116.528 2.048 . . . . 0.0 116.528 -169.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -97.71 5.77 48.83 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 121.714 -0.616 . . . . 0.0 111.887 -174.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.599 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 17.3 m95 -101.14 135.95 41.78 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 120.647 0.261 . . . . 0.0 111.302 -174.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.5 mm? -93.83 130.4 39.88 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.505 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 25.8 p -96.43 130.25 43.61 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -175.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -151.09 119.44 6.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.954 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.8 mtm180 54.68 46.36 24.85 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 125.849 1.659 . . . . 0.0 112.796 175.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 69.73 36.27 2.15 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.136 0.974 . . . . 0.0 111.026 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 12' ' ' SER . 10.2 mptt -141.72 159.83 41.42 Favored 'General case' 0 CA--C 1.499 -1.001 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 174.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.686 ' SG ' HD12 ' A' ' 126' ' ' LEU . 4.6 m -129.44 132.26 46.93 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 177.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -111.41 137.28 49.4 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 117.911 0.323 . . . . 0.0 110.832 -177.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.463 ' HB2' ' CE2' ' A' ' 10' ' ' TRP . 42.3 t-80 -121.11 108.33 13.67 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.7 t -88.22 93.59 4.31 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 176.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.716 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 4.1 m -77.76 113.56 15.75 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.053 -177.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.463 ' C ' ' HG2' ' A' ' 119' ' ' ARG . 13.4 mm100 -85.0 14.36 5.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.803 0.841 . . . . 0.0 111.962 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 13.9 m -105.68 157.21 6.38 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 179.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 m -110.4 147.29 34.3 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -169.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.404 ' HB3' ' HB3' ' A' ' 29' ' ' GLU . 35.2 m-20 -159.73 -178.07 6.81 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 126.491 1.916 . . . . 0.0 108.7 -178.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 71.2 p -86.5 170.38 11.98 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 171.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 87.9 t90 -59.91 -51.58 69.09 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.016 0.436 . . . . 0.0 110.43 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.482 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 49.9 mt-10 -67.47 -31.23 71.24 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.726 -177.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 7.8 tp10 -67.21 -49.55 64.13 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.88 -31.92 80.1 Favored Glycine 0 C--N 1.344 0.975 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.782 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.482 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 3.1 tm? -55.2 -51.29 67.03 Favored 'General case' 0 C--O 1.251 1.158 0 C-N-CA 124.17 0.988 . . . . 0.0 109.04 176.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 57.5 t -67.06 -35.09 73.64 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.468 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.43 -36.55 76.1 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 176.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 61.8 m -70.61 -41.86 71.72 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.417 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -61.74 -25.66 67.58 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.88 -37.16 93.89 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.761 -0.654 . . . . 0.0 113.199 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -86.46 2.73 46.77 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.858 -0.201 . . . . 0.0 110.779 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.52 41.38 30.02 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 108.665 -1.774 . . . . 0.0 108.665 -174.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -132.83 177.07 7.92 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.783 -0.708 . . . . 0.0 109.227 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.43 ' HB ' HD12 ' A' ' 80' ' ' ILE . 2.7 p -120.9 154.04 36.41 Favored 'General case' 0 C--N 1.279 -2.479 0 O-C-N 123.634 0.584 . . . . 0.0 109.498 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.6 tp -66.05 139.81 58.22 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 172.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.9 tpt -35.82 118.75 0.52 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 114.681 1.364 . . . . 0.0 114.681 -170.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.0 tp -120.51 106.35 11.72 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 -174.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.44 ' HB ' ' CH2' ' A' ' 79' ' ' TRP . 30.7 mt -98.05 112.96 31.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 CA-C-O 121.25 0.548 . . . . 0.0 111.949 -169.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -90.16 -31.22 17.16 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.67 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -143.65 161.54 38.27 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -173.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.496 ' NE2' ' HA ' ' A' ' 89' ' ' VAL . 6.9 tt0 -74.32 -25.36 59.51 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 122.536 0.334 . . . . 0.0 110.565 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.649 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 7.7 pt-20 -69.08 -26.13 64.79 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.935 176.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -57.27 -54.1 50.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 173.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.473 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 62.4 mt -67.69 -26.8 66.36 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.649 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 4.1 ppt_? -66.45 -36.6 83.18 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -73.44 -25.74 60.64 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.67 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -63.53 -48.82 75.96 Favored 'General case' 0 CA--C 1.477 -1.848 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 172.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 37.7 mt -55.12 -38.8 68.65 Favored 'General case' 0 C--O 1.244 0.784 0 O-C-N 123.756 0.66 . . . . 0.0 110.717 177.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -59.16 -43.19 92.1 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.73 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.8 p -81.26 -27.01 35.34 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' ' 53' ' ' LEU . 32.7 mm -67.1 -58.21 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.562 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -178.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? 67.36 -59.07 0.41 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.84 0.856 . . . . 0.0 112.921 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -61.04 -60.36 3.9 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 123.079 0.552 . . . . 0.0 112.418 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt 71.16 15.51 6.47 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.9 0.88 . . . . 0.0 113.044 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 67.0 m-85 -125.59 30.84 5.66 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.631 0.729 . . . . 0.0 111.62 -179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.459 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 65.2 m-80 -127.11 -159.66 0.95 Allowed 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 175.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.616 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 54.7 m -151.97 126.68 9.54 Favored 'General case' 0 C--O 1.25 1.107 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 173.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.532 ' CE2' HD12 ' A' ' 57' ' ' ILE . 1.1 m-85 -128.83 118.78 23.32 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -176.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 70.3 m95 -59.38 140.14 56.39 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 123.804 0.842 . . . . 0.0 112.018 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -119.53 174.48 4.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 169.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.636 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.84 58.54 3.48 Favored Glycine 0 C--O 1.205 -1.703 0 CA-C-N 119.294 0.952 . . . . 0.0 113.76 -175.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.9 mt -127.44 113.86 16.74 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 123.743 0.817 . . . . 0.0 111.282 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -122.42 137.65 54.8 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -93.52 113.06 25.09 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 9.3 p . . . . . 0 C--N 1.293 -1.875 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.413 -174.858 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 10.9 m120 . . . . . 0 CA--C 1.498 -1.056 0 CA-C-O 120.89 0.376 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -87.88 125.4 34.46 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 176.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -124.0 155.3 38.49 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 119.689 -0.804 . . . . 0.0 111.125 175.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.636 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 19.3 m95 -90.53 176.01 6.85 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 114.548 -1.205 . . . . 0.0 108.522 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.43 HD12 ' HB ' ' A' ' 40' ' ' THR . 49.8 pt -72.71 -15.48 17.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -177.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.481 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 30.5 p-10 -88.11 -7.97 56.14 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.73 8.08 62.44 Favored Glycine 0 N--CA 1.444 -0.816 0 CA-C-N 114.771 -1.104 . . . . 0.0 113.766 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.4 t -81.09 167.82 19.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.323 0.562 . . . . 0.0 109.613 -179.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.1 m -90.46 139.68 30.45 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 35.0 tp -55.18 138.99 43.48 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.015 173.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.463 ' OD1' HG11 ' A' ' 89' ' ' VAL . 26.4 t-20 -98.29 91.46 5.24 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 170.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 39.5 p -71.88 -4.92 30.89 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.3 0.572 . . . . 0.0 111.849 -177.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -75.43 -18.13 59.99 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.555 -178.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.496 ' HA ' ' NE2' ' A' ' 47' ' ' GLN . 33.6 m -75.41 -55.47 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.511 0 C-N-CA 119.111 -1.036 . . . . 0.0 112.494 -177.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 87.0 mt -145.51 -177.8 5.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.014 0.435 . . . . 0.0 111.344 -172.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.555 ' O ' ' HB ' ' A' ' 109' ' ' VAL . 10.7 tptm -57.72 98.69 0.03 OUTLIER 'General case' 0 C--O 1.208 -1.093 0 C-N-CA 125.866 1.666 . . . . 0.0 112.182 176.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.441 HG12 ' HB ' ' A' ' 109' ' ' VAL . 4.8 mt -150.69 111.02 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.911 0 N-CA-C 106.822 -1.548 . . . . 0.0 106.822 171.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.1 m -71.45 133.7 46.07 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 177.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.81 -53.99 3.2 Favored Glycine 0 CA--C 1.47 -2.753 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -173.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -96.87 132.02 43.03 Favored 'General case' 0 N--CA 1.421 -1.894 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.9 t -152.25 -19.92 0.17 Allowed 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.804 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 60.88 36.14 19.04 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 123.964 0.906 . . . . 0.0 113.377 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -117.47 171.73 7.8 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.693 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -93.85 28.32 2.43 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 125.762 1.625 . . . . 0.0 108.021 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 66.8 m -84.11 155.73 22.49 Favored 'General case' 0 N--CA 1.422 -1.854 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -169.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 84.0 m -131.63 149.33 52.53 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 105.858 -1.904 . . . . 0.0 105.858 171.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -91.09 146.45 23.83 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -173.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.48 144.84 32.16 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.588 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.616 ' O ' ' HA ' ' A' ' 63' ' ' SER . 7.7 mm -77.33 124.74 36.29 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 177.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 23.3 t -94.07 -43.21 8.61 Favored 'General case' 0 N--CA 1.414 -2.233 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 173.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.52 -109.36 0.22 Allowed Glycine 0 N--CA 1.418 -2.563 0 N-CA-C 109.12 -1.592 . . . . 0.0 109.12 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -75.81 -19.16 59.16 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -110.89 154.47 24.0 Favored 'General case' 0 C--O 1.259 1.589 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.201 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 91' ' ' LYS . 23.6 t -106.0 130.03 58.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 175.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.0 p -130.94 151.65 51.13 Favored 'General case' 0 C--N 1.27 -2.887 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -174.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 19.7 p90 -126.83 133.11 50.83 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 -173.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -129.46 174.51 9.57 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' SER . . . . . 0.448 ' HB3' ' ND2' ' A' ' 115' ' ' ASN . 19.7 m -53.94 129.96 35.84 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.76 0.662 . . . . 0.0 109.224 174.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.2 m -58.87 -20.55 52.18 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.864 0.866 . . . . 0.0 112.33 -174.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . 0.448 ' ND2' ' HB3' ' A' ' 113' ' ' SER . 9.7 p30 -80.6 -9.08 59.8 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.291 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 51.0 p -68.02 144.8 54.98 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 120.346 -0.541 . . . . 0.0 110.753 -177.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -80.84 89.32 5.83 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.504 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' ASN . . . . . 0.532 ' OD1' ' HB2' ' A' ' 63' ' ' SER . 35.1 m-80 -125.92 170.48 11.63 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.449 -178.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.716 ' HB3' ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -89.82 179.6 5.95 Favored 'General case' 0 C--N 1.287 -2.117 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 -178.304 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.4 ' CZ3' HG22 ' A' ' 23' ' ' VAL . 17.9 p90 -153.24 165.01 37.06 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.757 1.162 . . . . 0.0 112.201 -175.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 80.8 mt -120.18 127.31 75.89 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.973 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 70.9 m -106.89 142.58 36.29 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.44 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.3 pt20 -124.18 135.93 53.82 Favored 'General case' 0 N--CA 1.417 -2.093 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 171.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -108.94 109.25 20.28 Favored 'General case' 0 C--N 1.254 -3.554 0 N-CA-C 105.411 -2.07 . . . . 0.0 105.411 174.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -68.62 124.4 23.5 Favored 'General case' 0 N--CA 1.414 -2.241 0 N-CA-C 104.499 -2.408 . . . . 0.0 104.499 174.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.686 HD12 ' SG ' ' A' ' 17' ' ' CYS . 6.8 tp . . . . . 0 C--N 1.284 -2.261 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.598 -166.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.471 ' HB2' ' HB3' ' A' ' 126' ' ' LEU . 5.0 mp . . . . . 0 C--O 1.244 0.769 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -95.34 141.17 29.22 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.583 0.706 . . . . 0.0 111.343 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . 0.413 ' HB3' HD13 ' A' ' 126' ' ' LEU . 14.6 p -125.95 170.76 8.9 Favored Pre-proline 0 C--N 1.29 -2.006 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.026 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.636 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 52.3 Cg_exo -58.42 152.77 51.99 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 122.855 2.37 . . . . 0.0 112.487 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -58.55 -31.63 68.14 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 -171.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -89.92 8.68 31.03 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.405 0.622 . . . . 0.0 110.641 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.636 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 31.8 m95 -111.4 131.23 55.35 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.913 -176.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.7 mm? -85.2 117.71 24.31 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . 0.638 ' HA ' ' SG ' ' A' ' 17' ' ' CYS . 1.8 m -78.95 123.59 27.42 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.96 -175.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 27.7 t-80 -145.29 114.11 6.86 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 122.019 -0.425 . . . . 0.0 110.044 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 71.02 -85.17 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.31 1.044 . . . . 0.0 111.88 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -146.42 19.2 1.36 Allowed 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 123.816 0.847 . . . . 0.0 109.98 -176.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.498 ' HG2' ' NE2' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -143.56 160.33 40.82 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 175.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.638 ' SG ' ' HA ' ' A' ' 12' ' ' SER . 79.3 m -125.99 142.3 51.58 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 173.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -110.8 144.04 40.41 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.738 0.304 . . . . 0.0 111.684 -171.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -123.25 109.07 13.5 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 176.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.7 t -83.92 91.94 2.86 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.721 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 6.5 m -78.33 105.84 9.85 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.493 HE22 ' ND2' ' A' ' 62' ' ' ASN . 12.3 mm100 -77.49 14.43 1.0 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.47 1.108 . . . . 0.0 112.65 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.483 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.0 m -108.62 157.92 8.66 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.932 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.4 m -106.84 156.77 18.33 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -171.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 33.4 m-20 -167.81 175.29 6.96 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 128.024 2.53 . . . . 0.0 107.948 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.1 p -82.01 176.61 9.4 Favored 'General case' 0 C--O 1.257 1.471 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 171.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -61.81 -50.86 70.62 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.276 49.1 mt-10 -67.68 -30.62 70.19 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.81 -49.26 68.89 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.818 -0.753 . . . . 0.0 110.965 172.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.85 -33.9 86.93 Favored Glycine 0 C--N 1.339 0.741 0 N-CA-C 111.522 -0.631 . . . . 0.0 111.522 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.33 -52.87 62.07 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.848 0.859 . . . . 0.0 108.992 176.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.48 -31.8 52.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.198 0.523 . . . . 0.0 111.019 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.419 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 1.0 OUTLIER -62.46 -36.38 82.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.487 176.625 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.3 m -68.1 -41.09 82.32 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 175.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -57.36 -35.92 70.56 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.413 0.625 . . . . 0.0 109.622 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -63.08 -14.54 53.63 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 115.013 -0.994 . . . . 0.0 114.061 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . 0.419 ' HD2' ' O ' ' A' ' 33' ' ' ASP . 3.3 mptp? -108.36 3.54 23.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 117.622 0.711 . . . . 0.0 110.644 176.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.87 28.79 66.2 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -174.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -118.51 176.84 5.06 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 124.261 1.024 . . . . 0.0 108.705 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -123.52 149.69 44.9 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.56 125.57 25.61 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 177.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.4 tpt -26.62 121.98 0.08 Allowed 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 116.732 2.123 . . . . 0.0 116.732 -169.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -112.16 105.27 13.57 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.927 1.291 . . . . 0.0 107.599 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.418 HD13 HD13 ' A' ' 50' ' ' LEU . 56.5 mt -85.3 117.94 31.29 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.134 -175.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -82.5 -54.49 5.15 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.265 0.555 . . . . 0.0 111.404 179.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.518 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 17.1 m-20 -137.04 -179.02 5.46 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 122.119 -0.363 . . . . 0.0 111.072 -171.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -39.63 80.72 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 -178.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -58.71 -28.26 65.65 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.792 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.518 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 6.5 mm-40 -60.21 -55.18 36.9 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 175.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.632 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 46.3 mt -68.85 -26.09 64.97 Favored 'General case' 0 C--O 1.202 -1.424 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -177.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -64.25 -38.32 90.63 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.308 -0.557 . . . . 0.0 109.694 174.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -73.1 -28.5 62.32 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.614 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -66.22 -51.89 53.2 Favored 'General case' 0 C--O 1.183 -2.425 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 174.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 50.9 mt -54.8 -33.36 61.39 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -72.89 -46.21 53.98 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.543 174.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.3 p -75.53 -27.04 58.54 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.127 0.489 . . . . 0.0 111.831 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 53' ' ' LEU . 34.2 mm -58.7 -48.92 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.243 174.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? 67.99 -66.41 0.22 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.037 0.935 . . . . 0.0 112.667 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -62.01 -51.28 68.67 Favored 'General case' 0 C--O 1.207 -1.142 0 C-N-CA 123.842 0.857 . . . . 0.0 111.131 -176.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.448 ' H ' HG23 ' A' ' 57' ' ' ILE . 3.8 ttmp? 71.31 -40.85 0.49 Allowed 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -80.81 37.68 0.43 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.787 0.803 . . . . 0.0 112.911 -174.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.569 ' O ' ' HA ' ' A' ' 105' ' ' SER . 54.2 m-80 -124.97 -158.88 0.85 Allowed 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 176.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.47 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 15.3 m -143.28 117.82 9.75 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.513 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 2.2 m-85 -122.56 117.5 26.03 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -63.15 139.77 58.81 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 123.063 0.545 . . . . 0.0 111.428 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -117.76 172.76 5.09 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 168.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.58 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -74.92 44.09 1.5 Allowed Glycine 0 C--O 1.216 -1.01 0 CA-C-N 119.132 0.878 . . . . 0.0 114.544 -174.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.507 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 28.8 mt -114.37 123.68 50.07 Favored 'General case' 0 CA--C 1.483 -1.614 0 C-N-CA 123.793 0.837 . . . . 0.0 111.898 -178.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -142.52 140.69 31.91 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 120.086 -0.645 . . . . 0.0 110.076 171.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.558 ' HD2' ' O ' ' A' ' 98' ' ' ASN . 82.9 t80 -83.02 113.21 20.43 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 32.5 p . . . . . 0 C--N 1.283 -2.284 0 C-N-CA 119.856 -0.738 . . . . 0.0 112.325 -173.754 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 14.8 m120 . . . . . 0 C--O 1.255 1.35 0 CA-C-O 121.26 0.552 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.441 ' HE1' ' HA2' ' A' ' 94' ' ' GLY . 83.0 m95 -88.92 112.71 23.63 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 173.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -116.86 154.64 30.41 Favored 'General case' 0 C--N 1.278 -2.504 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.922 -176.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.58 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 47.2 m95 -98.55 165.5 11.79 Favored 'General case' 0 N--CA 1.425 -1.722 0 CA-C-N 114.504 -1.225 . . . . 0.0 109.353 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.1 pt -73.28 -13.76 16.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.063 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.421 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 29.4 p-10 -92.61 -0.66 57.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.396 0.617 . . . . 0.0 109.844 -178.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.46 -2.72 57.59 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.016 -0.993 . . . . 0.0 114.256 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.1 t -84.82 170.6 13.01 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 117.609 0.705 . . . . 0.0 109.852 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.3 m -112.15 145.49 39.72 Favored 'General case' 0 N--CA 1.419 -2.004 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.0 tp -53.86 131.98 40.87 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -178.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -86.51 87.85 7.52 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 168.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.2 m -64.18 -10.88 25.82 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.923 -177.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -77.72 -6.56 54.41 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 22.6 m -74.32 -48.96 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 118.764 -1.174 . . . . 0.0 111.924 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.2 mt -156.72 -178.09 7.09 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 -175.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -73.49 123.31 23.67 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.0 mt -142.59 132.33 22.6 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 N-CA-C 105.721 -1.955 . . . . 0.0 105.721 171.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.2 m -112.71 131.94 55.43 Favored 'General case' 0 C--N 1.288 -2.083 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.192 -173.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . 0.441 ' HA2' ' HE1' ' A' ' 77' ' ' TRP . . . -91.87 -14.46 56.44 Favored Glycine 0 N--CA 1.426 -2.028 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -77.25 111.16 12.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 174.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.5 t -171.32 -42.86 0.02 OUTLIER 'General case' 0 C--N 1.274 -2.674 0 CA-C-N 114.473 -1.239 . . . . 0.0 108.43 -175.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 68.09 19.06 9.34 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.145 1.378 . . . . 0.0 111.373 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.558 ' O ' ' HD2' ' A' ' 70' ' ' TYR . 26.3 m-80 -121.71 152.9 38.9 Favored 'General case' 0 CA--C 1.498 -1.048 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -72.16 30.46 0.05 Allowed 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 126.346 1.858 . . . . 0.0 110.527 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.471 ' H ' ' C ' ' A' ' 98' ' ' ASN . 41.0 t -62.36 149.07 43.35 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 126.14 1.776 . . . . 0.0 112.802 -172.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 90.1 m -112.92 145.31 40.97 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.067 -0.969 . . . . 0.0 108.794 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -98.0 147.2 24.74 Favored 'General case' 0 C--O 1.255 1.364 0 CA-C-O 121.3 0.571 . . . . 0.0 111.898 -176.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -139.53 152.21 46.74 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.486 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.47 ' O ' ' HA ' ' A' ' 63' ' ' SER . 17.3 mm -77.85 112.53 15.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 N-CA-C 105.388 -2.079 . . . . 0.0 105.388 172.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' SER . . . . . 0.569 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 8.5 t -131.82 33.53 3.96 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-O 122.376 1.084 . . . . 0.0 108.511 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.66 -139.82 6.65 Favored Glycine 0 N--CA 1.412 -2.913 0 N-CA-C 108.277 -1.929 . . . . 0.0 108.277 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.425 ' OD2' ' HE3' ' A' ' 108' ' ' LYS . 14.2 p-10 -98.99 8.82 44.64 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . 0.425 ' HE3' ' OD2' ' A' ' 107' ' ' ASP . 32.4 mmtp -130.43 163.65 26.46 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.102 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.11 119.83 47.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.1 p -122.04 143.78 49.3 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 23.6 p90 -109.67 145.86 35.8 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -173.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -135.76 175.43 9.6 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.79 -1.096 . . . . 0.0 109.942 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.3 m -67.57 127.06 31.33 Favored 'General case' 0 N--CA 1.413 -2.305 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 171.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 20.5 m -56.33 -21.79 26.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.465 0.706 . . . . 0.0 112.585 -173.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -77.15 -3.46 39.59 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 30.6 p -75.97 140.39 42.02 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 119.316 0.962 . . . . 0.0 111.389 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.58 89.1 7.05 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.546 0.689 . . . . 0.0 109.444 -177.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -120.78 174.38 6.63 Favored 'General case' 0 C--O 1.196 -1.759 0 C-N-CA 124.563 1.145 . . . . 0.0 109.832 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.721 ' HB3' ' O ' ' A' ' 21' ' ' SER . 3.4 mpt_? -85.87 -178.77 6.67 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -176.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 24.8 p90 -153.18 162.77 40.93 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 118.688 -1.205 . . . . 0.0 111.999 -176.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 75.6 mt -120.13 125.57 74.37 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-O 121.237 0.542 . . . . 0.0 109.856 178.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 71.7 m -105.24 145.25 30.9 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 176.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.498 ' NE2' ' HG2' ' A' ' 16' ' ' LYS . 8.7 pt20 -122.61 133.5 54.54 Favored 'General case' 0 N--CA 1.412 -2.326 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 171.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -110.66 108.0 17.76 Favored 'General case' 0 N--CA 1.397 -3.124 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 173.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -68.74 134.43 49.77 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-N 113.989 -1.459 . . . . 0.0 108.365 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 4' ' ' LEU . 1.7 mm? . . . . . 0 C--N 1.31 -1.11 0 CA-C-O 121.782 0.801 . . . . 0.0 109.404 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.497 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 5.0 mp . . . . . 0 N--CA 1.426 -1.657 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -80.67 140.52 35.6 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.766 0.793 . . . . 0.0 112.583 -176.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.8 p -128.18 165.92 27.52 Favored Pre-proline 0 C--N 1.296 -1.759 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.517 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.684 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 52.4 Cg_exo -54.08 162.16 4.34 Favored 'Trans proline' 0 C--N 1.373 1.826 0 C-N-CA 123.222 2.615 . . . . 0.0 115.084 -178.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -59.78 -35.49 74.75 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 115.212 1.56 . . . . 0.0 115.212 -173.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -89.7 3.08 53.85 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -175.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.684 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 16.9 m95 -101.11 153.11 19.86 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.628 -171.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -108.38 124.4 50.31 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.8 p -90.82 126.61 36.08 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -176.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.444 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 54.1 t-80 -146.21 115.13 6.93 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 123.002 0.521 . . . . 0.0 110.086 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.25 3.9 mpt_? 53.58 59.14 4.53 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 174.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 62.65 24.83 14.78 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.446 174.627 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -145.67 148.01 32.6 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.3 t -130.78 134.48 46.9 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -176.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 11.8 m-85 -111.77 149.87 31.09 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -170.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.499 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 45.3 t-80 -129.52 116.94 19.68 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 172.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.01 93.57 3.87 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 174.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.711 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 13.3 m -77.8 107.76 10.54 Favored 'General case' 0 N--CA 1.416 -2.159 0 CA-C-N 115.306 -0.861 . . . . 0.0 108.696 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.412 HE22 ' ND2' ' A' ' 62' ' ' ASN . 11.5 mm100 -83.55 13.92 4.17 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.603 0.716 . . . . 0.0 111.15 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.464 HG23 ' CH2' ' A' ' 120' ' ' TRP . 5.7 m -100.62 158.32 3.99 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.149 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.2 m -109.97 151.59 26.93 Favored 'General case' 0 C--N 1.294 -1.81 0 C-N-CA 118.776 -1.17 . . . . 0.0 114.091 -171.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -167.09 174.66 8.11 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 127.39 2.276 . . . . 0.0 108.426 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.5 p -86.37 171.89 10.83 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 107.443 -1.318 . . . . 0.0 107.443 170.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -56.54 -52.99 62.68 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -174.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -31.26 70.38 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.956 0.408 . . . . 0.0 111.779 -175.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -70.23 -45.25 66.89 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.888 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.88 -32.04 82.83 Favored Glycine 0 C--N 1.341 0.824 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.0 tt -56.42 -51.21 69.24 Favored 'General case' 0 C--O 1.242 0.682 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 176.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.1 t -67.8 -33.24 60.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.839 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -60.11 -37.06 78.87 Favored 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 82.9 m -65.32 -42.35 93.07 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -61.16 -27.73 68.61 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.194 177.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -58.64 -34.98 78.89 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.576 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -95.73 8.93 42.09 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 122.26 -0.553 . . . . 0.0 109.704 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.8 43.67 93.58 Favored Glycine 0 CA--C 1.503 -0.68 0 N-CA-C 109.695 -1.362 . . . . 0.0 109.695 -175.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -130.05 174.91 9.33 Favored 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 -177.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -119.29 150.83 39.47 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 118.454 0.57 . . . . 0.0 110.972 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 25.9 tp -65.6 124.74 23.17 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.1 tpt -29.98 120.01 0.17 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 -169.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -109.3 110.6 21.82 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 114.191 -1.368 . . . . 0.0 107.505 176.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.9 mt -96.96 117.66 41.93 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -175.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -100.2 -25.1 14.38 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -137.05 160.42 39.01 Favored 'General case' 0 CA--C 1.5 -0.973 0 CA-C-O 120.669 0.271 . . . . 0.0 110.77 -175.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -33.97 74.93 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.3 mp0 -58.6 -29.39 66.42 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.04 178.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -62.17 -54.45 40.86 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.639 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 58.1 mt -65.28 -26.01 67.9 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -62.9 -41.6 99.49 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -72.45 -28.06 62.7 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.588 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -64.11 -50.75 67.03 Favored 'General case' 0 C--O 1.18 -2.603 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 175.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.639 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 51.1 mt -54.86 -35.18 63.74 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 122.878 0.471 . . . . 0.0 111.974 -178.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.04 -42.34 73.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.296 -0.411 . . . . 0.0 112.102 175.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.6 p -81.63 -26.43 34.82 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.204 0.526 . . . . 0.0 112.283 -176.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 53' ' ' LEU . 35.4 mm -64.08 -47.36 90.56 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 tptt 67.1 -68.98 0.14 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.689 1.196 . . . . 0.0 112.62 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -65.48 -47.59 75.55 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -175.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 75.17 -39.28 0.4 Allowed 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.639 1.176 . . . . 0.0 113.923 177.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -73.29 37.84 0.09 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -173.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.566 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 60.9 m-80 -128.0 -163.1 1.23 Allowed 'General case' 0 C--N 1.277 -2.578 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 174.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.626 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 50.3 m -139.16 119.54 13.81 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 176.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.566 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 6.2 m-85 -120.91 116.17 24.62 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -177.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . 0.418 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 71.5 m95 -61.81 138.85 58.37 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 123.596 0.758 . . . . 0.0 111.492 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.14 175.63 4.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.149 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 168.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.621 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.04 47.96 2.33 Favored Glycine 0 C--O 1.209 -1.438 0 C-N-CA 120.784 -0.722 . . . . 0.0 114.375 -174.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.7 mt -114.25 121.72 44.57 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 123.283 0.633 . . . . 0.0 111.843 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -129.4 134.29 47.79 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.226 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -87.39 112.82 22.52 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.506 ' OG1' ' HE2' ' A' ' 78' ' ' LYS . 46.6 p . . . . . 0 C--N 1.307 -1.275 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.128 -172.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.7 m120 . . . . . 0 N--CA 1.433 -1.283 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -86.93 119.93 27.67 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 175.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . 0.506 ' HE2' ' OG1' ' A' ' 71' ' ' THR . 55.9 mttm -113.22 152.29 29.94 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -177.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.621 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 42.5 m95 -98.03 175.91 5.95 Favored 'General case' 0 C--N 1.288 -2.094 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 46.0 pt -71.93 -23.2 21.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 120.95 0.405 . . . . 0.0 111.334 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.402 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 32.3 p-10 -85.69 -9.68 56.83 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.628 0.728 . . . . 0.0 109.69 179.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.21 -0.08 44.11 Favored Glycine 0 CA--C 1.495 -1.18 0 CA-C-N 115.39 -0.823 . . . . 0.0 112.382 172.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.1 m -69.8 168.22 15.56 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 28.8 m -108.94 134.43 51.61 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.622 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.411 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 44.3 tp -54.45 142.27 27.85 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 124.84 1.256 . . . . 0.0 114.047 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -96.12 97.1 9.3 Favored 'General case' 0 N--CA 1.432 -1.335 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 169.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.1 m -70.65 -6.11 34.53 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.222 0.534 . . . . 0.0 111.328 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -78.3 -6.21 54.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.079 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.3 m -78.74 -54.47 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.31 0 C-N-CA 119.364 -0.934 . . . . 0.0 112.195 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 91.5 mt -157.37 -178.16 7.14 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.577 0.751 . . . . 0.0 109.188 -174.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.6 98.47 0.37 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -177.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 8.8 mt -139.23 103.54 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 173.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' THR . . . . . 0.414 HG23 ' H ' ' A' ' 95' ' ' ASP . 9.7 m -76.05 132.31 40.03 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.086 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -106.26 12.61 44.14 Favored Glycine 0 CA--C 1.489 -1.559 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -177.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . 0.414 ' H ' HG23 ' A' ' 93' ' ' THR . 7.2 p-10 -140.97 96.73 3.05 Favored 'General case' 0 C--N 1.285 -2.219 0 CA-C-O 121.557 0.694 . . . . 0.0 109.64 176.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.1 t -148.43 -20.48 0.33 Allowed 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.396 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 56.81 82.08 0.12 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.983 0.913 . . . . 0.0 112.888 -177.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -157.0 178.06 10.8 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -108.83 26.17 10.89 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 123.137 1.446 . . . . 0.0 107.475 179.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.413 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 19.1 m -66.75 153.42 43.33 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -173.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -132.88 145.71 51.17 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 113.606 -1.634 . . . . 0.0 107.0 173.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -92.16 148.24 22.31 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -171.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.49 153.32 42.5 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.48 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.626 ' O ' ' HA ' ' A' ' 63' ' ' SER . 14.2 mm -77.7 120.14 27.75 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 174.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 34.1 t -134.97 94.21 3.12 Favored 'General case' 0 N--CA 1.421 -1.881 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.24 -126.41 8.09 Favored Glycine 0 N--CA 1.429 -1.825 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -102.3 8.39 40.38 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -126.74 166.83 16.66 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.263 -173.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 t -104.85 133.51 48.82 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.753 0 N-CA-C 104.766 -2.309 . . . . 0.0 104.766 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 43.2 p -127.98 170.47 12.83 Favored 'General case' 0 C--N 1.278 -2.501 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.413 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 11.3 p90 -130.35 125.28 34.23 Favored 'General case' 0 C--N 1.296 -1.758 0 C-N-CA 119.619 -0.832 . . . . 0.0 112.598 178.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -118.06 170.82 8.54 Favored 'General case' 0 C--N 1.294 -1.824 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.712 -172.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 19.1 m -72.0 127.84 33.82 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 170.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.6 m -50.71 -22.14 1.95 Allowed 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 125.495 1.518 . . . . 0.0 113.553 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.51 7.43 9.93 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 124.387 1.075 . . . . 0.0 111.561 -175.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 18.5 p -92.13 140.38 29.69 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.582 -0.699 . . . . 0.0 111.777 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -78.65 90.42 4.58 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.8 0.81 . . . . 0.0 109.294 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -126.61 -178.58 4.42 Favored 'General case' 0 C--O 1.196 -1.746 0 CA-C-N 114.94 -1.027 . . . . 0.0 108.991 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.711 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.7 mpt_? -100.85 -175.44 2.89 Favored 'General case' 0 C--N 1.283 -2.293 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 -175.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.464 ' CH2' HG23 ' A' ' 23' ' ' VAL . 26.9 p90 -154.27 169.69 23.05 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 119.492 1.042 . . . . 0.0 112.199 -176.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 74.2 mt -122.22 125.74 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 CA-C-O 121.4 0.619 . . . . 0.0 109.855 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 87.0 m -104.1 142.82 33.8 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.448 -0.796 . . . . 0.0 108.929 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -117.93 132.76 56.37 Favored 'General case' 0 N--CA 1.413 -2.305 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 172.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . 0.524 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 42.9 tttp -109.98 106.49 16.03 Favored 'General case' 0 C--N 1.251 -3.7 0 N-CA-C 104.048 -2.575 . . . . 0.0 104.048 173.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -83.53 124.73 31.04 Favored 'General case' 0 N--CA 1.41 -2.437 0 CA-C-N 114.357 -1.292 . . . . 0.0 109.902 -170.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.497 ' HG ' ' H ' ' A' ' 4' ' ' LEU . 1.5 mm? . . . . . 0 N--CA 1.43 -1.451 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.264 -175.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.437 ' H ' ' CD2' ' A' ' 126' ' ' LEU . 3.6 mp . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -94.31 145.03 25.03 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 118.419 0.554 . . . . 0.0 111.189 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 71.0 m -113.25 164.08 16.55 Favored Pre-proline 0 C--N 1.301 -1.511 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.466 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 38.5 Cg_exo -60.75 157.67 36.6 Favored 'Trans proline' 0 C--N 1.368 1.573 0 C-N-CA 121.448 1.432 . . . . 0.0 110.956 174.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -44.13 -45.35 8.17 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -92.47 2.18 56.82 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.513 -172.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.466 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 23.9 m95 -99.98 126.87 46.22 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.793 0.806 . . . . 0.0 111.788 -173.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.2 tp -84.69 119.41 25.22 Favored 'General case' 0 N--CA 1.412 -2.347 0 CA-C-N 113.753 -1.567 . . . . 0.0 108.081 -175.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.6 t -92.72 130.79 38.23 Favored 'General case' 0 C--N 1.272 -2.781 0 CA-C-O 120.897 0.38 . . . . 0.0 111.092 -173.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.443 ' CE1' ' HG2' ' A' ' 14' ' ' ARG . 48.3 t-80 -153.31 130.03 10.83 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 123.212 0.605 . . . . 0.0 109.696 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.443 ' HG2' ' CE1' ' A' ' 13' ' ' HIS . 24.0 mmt180 65.11 -81.04 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.439 1.495 . . . . 0.0 113.011 178.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -157.77 26.07 0.27 Allowed 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 -174.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -141.98 163.75 32.03 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.441 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.669 ' SG ' HD13 ' A' ' 126' ' ' LEU . 13.1 m -123.96 131.07 53.51 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 176.402 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.416 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 22.6 m-85 -111.15 135.73 51.23 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 120.999 0.428 . . . . 0.0 111.907 -175.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -121.53 102.08 8.02 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 173.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -81.1 95.18 2.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.74 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 9.4 m -77.77 108.03 10.71 Favored 'General case' 0 N--CA 1.414 -2.248 0 CA-C-N 115.416 -0.811 . . . . 0.0 108.98 -178.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.505 HE22 ' ND2' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -83.34 14.79 3.34 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.997 0.919 . . . . 0.0 112.67 -179.409 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.4 m -105.7 158.89 6.02 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.801 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 178.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -111.4 148.38 33.18 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -171.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -158.15 -176.69 6.06 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 127.379 2.272 . . . . 0.0 107.825 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.7 p -84.68 176.62 8.45 Favored 'General case' 0 C--O 1.258 1.525 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 171.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.9 t90 -63.02 -47.0 84.93 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 43.1 mt-10 -67.76 -38.01 82.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.946 -177.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.33 -46.07 85.13 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.456 -0.498 . . . . 0.0 111.429 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.9 -35.66 92.33 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 120.165 -1.017 . . . . 0.0 111.574 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.441 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 3.2 tm? -55.39 -52.16 64.45 Favored 'General case' 0 C--O 1.249 1.043 0 C-N-CA 123.797 0.839 . . . . 0.0 108.999 176.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 84.8 t -68.1 -32.59 56.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.971 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.8 -36.35 80.86 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.783 177.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.0 m -69.38 -40.37 77.47 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -60.44 -29.42 69.0 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.369 0.604 . . . . 0.0 109.589 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -60.76 -30.24 72.16 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.248 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -96.8 1.86 51.21 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 117.245 0.522 . . . . 0.0 111.027 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.0 53.28 9.55 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 108.53 -1.828 . . . . 0.0 108.53 -172.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -147.3 177.28 9.34 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.2 p -120.85 159.56 25.24 Favored 'General case' 0 C--N 1.284 -2.28 0 C-N-CA 122.917 0.487 . . . . 0.0 110.402 -176.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.7 tp -73.97 131.62 41.59 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 174.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.4 tpt -29.38 122.7 0.15 Allowed 'General case' 0 N--CA 1.506 2.333 0 N-CA-C 116.77 2.137 . . . . 0.0 116.77 -170.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.422 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 2.9 mm? -112.94 108.09 16.89 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.45 HD12 HD13 ' A' ' 50' ' ' LEU . 54.4 mt -83.38 118.15 30.43 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.7 0 O-C-N 122.211 -0.305 . . . . 0.0 110.556 -175.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -79.73 -45.79 18.26 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.16 -178.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -154.15 179.85 8.56 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -174.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.3 -36.27 79.08 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -60.3 -27.89 67.67 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.498 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -68.17 -52.13 38.05 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.551 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.4 mt -66.22 -24.26 66.58 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -64.71 -35.93 82.65 Favored 'General case' 0 N--CA 1.393 -3.285 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -72.1 -31.74 66.34 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.265 175.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.591 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.4 mm? -64.21 -52.67 57.69 Favored 'General case' 0 C--O 1.192 -1.922 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 45.4 mt -54.77 -40.63 69.59 Favored 'General case' 0 C--O 1.252 1.233 0 C-N-CA 123.178 0.591 . . . . 0.0 112.246 -177.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -70.2 -36.8 74.85 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 178.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.8 p -81.96 -33.55 30.19 Favored 'General case' 0 C--N 1.31 -1.152 0 C-N-CA 120.824 -0.351 . . . . 0.0 111.451 -178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.591 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.1 mm -56.07 -45.97 80.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.609 0 C-N-CA 123.878 0.871 . . . . 0.0 109.545 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? 66.12 -68.64 0.13 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.435 1.094 . . . . 0.0 113.093 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -60.36 -38.64 84.5 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 124.656 1.183 . . . . 0.0 114.182 -174.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.471 ' HE2' ' OD2' ' A' ' 107' ' ' ASP . 41.8 mmtm 71.94 -53.34 0.69 Allowed 'General case' 0 C--O 1.212 -0.913 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 175.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -67.3 35.16 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 126.321 1.848 . . . . 0.0 114.494 -171.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.505 ' ND2' HE22 ' A' ' 22' ' ' GLN . 93.2 m-20 -127.49 -173.61 2.96 Favored 'General case' 0 C--N 1.273 -2.749 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 177.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.681 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 50.2 m -142.66 121.9 13.03 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 177.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.452 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 3.0 m-85 -123.64 117.6 25.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -176.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -60.77 139.02 58.05 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 123.53 0.732 . . . . 0.0 111.207 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -119.48 176.25 3.53 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 170.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.513 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.94 48.41 2.7 Favored Glycine 0 C--O 1.22 -0.745 0 CA-C-N 118.736 0.698 . . . . 0.0 114.128 -174.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 48.3 mt -113.1 115.42 28.28 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 123.295 0.638 . . . . 0.0 112.105 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -126.22 146.81 49.83 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 173.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . 0.441 ' HD2' ' O ' ' A' ' 98' ' ' ASN . 30.0 t80 -96.37 113.19 24.76 Favored 'General case' 0 C--N 1.277 -2.582 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -177.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 17.1 p . . . . . 0 C--N 1.297 -1.7 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.69 -175.341 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 10.5 m120 . . . . . 0 N--CA 1.419 -2.003 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -92.62 138.14 31.76 Favored 'General case' 0 C--N 1.281 -2.399 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -177.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -118.87 152.42 36.31 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.617 ' HB2' ' OD1' ' A' ' 81' ' ' ASN . 23.7 m95 -98.2 170.76 8.66 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 115.463 -0.79 . . . . 0.0 108.909 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 48.1 pt -73.23 -12.33 15.47 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.882 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.617 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 33.3 p-10 -86.17 -8.08 58.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.243 0.544 . . . . 0.0 109.665 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.39 6.48 57.54 Favored Glycine 0 CA--C 1.523 0.577 0 CA-C-N 114.903 -1.044 . . . . 0.0 113.473 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.5 t -96.05 174.16 7.06 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -178.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 59.3 m -106.55 145.55 31.72 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 121.256 0.551 . . . . 0.0 109.864 177.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 28.4 tp -54.23 144.21 20.77 Favored 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 125.987 1.715 . . . . 0.0 113.41 178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -92.34 89.83 6.99 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 170.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.8 m -70.37 -12.24 61.45 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.486 -175.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -77.66 -10.66 59.64 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.435 -176.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.4 m -75.46 -51.28 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -176.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.0 mt -155.21 -177.96 6.91 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -173.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.98 102.67 0.51 Allowed 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 114.72 1.378 . . . . 0.0 114.72 -179.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 7.7 mt -143.47 98.65 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 171.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.1 m -60.49 127.69 32.95 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.364 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.96 -43.8 5.89 Favored Glycine 0 N--CA 1.414 -2.808 0 N-CA-C 108.78 -1.728 . . . . 0.0 108.78 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -85.96 85.44 7.37 Favored 'General case' 0 N--CA 1.428 -1.575 0 CA-C-O 122.727 1.251 . . . . 0.0 110.925 177.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.1 t -122.16 -32.33 3.7 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.394 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 56.06 34.36 23.62 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.935 0.894 . . . . 0.0 111.811 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . 0.441 ' O ' ' HD2' ' A' ' 70' ' ' TYR . 35.1 m-80 -108.57 -171.7 1.91 Allowed 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.829 176.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -119.52 25.75 9.85 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-O 123.019 1.39 . . . . 0.0 107.299 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.422 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 22.9 t -73.9 157.65 35.89 Favored 'General case' 0 C--N 1.298 -1.65 0 CA-C-N 113.854 -1.521 . . . . 0.0 111.544 -174.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 72.2 m -121.59 144.89 48.48 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . 0.406 ' HA ' ' HA ' ' A' ' 111' ' ' PHE . . . -95.31 150.48 20.21 Favored 'General case' 0 C--O 1.251 1.15 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -173.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.19 154.43 43.85 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 124.571 1.148 . . . . 0.0 109.664 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.681 ' O ' ' HA ' ' A' ' 63' ' ' SER . 14.1 mm -77.65 116.27 20.87 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.354 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 173.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.4 t -129.3 93.11 3.49 Favored 'General case' 0 N--CA 1.405 -2.685 0 N-CA-C 106.749 -1.574 . . . . 0.0 106.749 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 87.79 -133.51 11.85 Favored Glycine 0 N--CA 1.431 -1.668 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . 0.471 ' OD2' ' HE2' ' A' ' 60' ' ' LYS . 8.1 m-20 -97.73 15.05 24.79 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 174.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -125.38 168.99 12.79 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.706 -174.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.2 t -115.53 133.32 62.25 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.003 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 173.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.7 p -129.15 167.79 17.08 Favored 'General case' 0 C--N 1.278 -2.514 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.422 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 6.2 p90 -122.74 128.08 50.04 Favored 'General case' 0 C--N 1.285 -2.234 0 CA-C-O 121.444 0.64 . . . . 0.0 111.105 176.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -120.81 170.02 9.86 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.805 -172.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.9 m -65.78 128.41 35.89 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 170.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 11.7 m -61.21 -18.91 60.64 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.242 0.617 . . . . 0.0 112.292 -172.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -88.84 0.16 56.8 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.935 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 64.7 p -80.32 150.09 30.05 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.989 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -76.76 106.15 8.25 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.142 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -143.67 172.46 12.79 Favored 'General case' 0 CA--C 1.489 -1.372 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.74 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.6 mpt_? -93.74 -174.82 3.56 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 -177.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 24.4 p90 -155.36 167.56 29.98 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 119.897 1.226 . . . . 0.0 111.619 -177.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 79.5 mt -124.06 123.55 66.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-O 121.234 0.54 . . . . 0.0 110.052 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 79.0 m -100.84 138.93 37.23 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.103 176.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.577 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.0 pt20 -123.43 140.49 52.95 Favored 'General case' 0 N--CA 1.413 -2.293 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 173.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -109.5 124.31 50.86 Favored 'General case' 0 C--N 1.246 -3.91 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 175.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -72.22 114.22 10.1 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 177.166 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.669 HD13 ' SG ' ' A' ' 17' ' ' CYS . 13.6 tp . . . . . 0 C--N 1.301 -1.501 0 CA-C-N 114.274 -1.33 . . . . 0.0 110.224 -171.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.485 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 4.8 mp . . . . . 0 CA--C 1.55 0.968 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -86.71 141.03 29.2 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 118.621 0.646 . . . . 0.0 112.178 -177.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.9 m -120.68 156.06 56.41 Favored Pre-proline 0 C--N 1.309 -1.186 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.955 177.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.482 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 15.4 Cg_exo -66.36 164.41 28.45 Favored 'Trans proline' 0 CA--C 1.55 1.279 0 C-N-CA 121.733 1.622 . . . . 0.0 111.344 174.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . 0.421 ' HG3' ' N ' ' A' ' 9' ' ' ASP . 11.4 pt20 -50.73 -46.1 58.92 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -173.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.421 ' N ' ' HG3' ' A' ' 8' ' ' GLN . 22.4 m-20 -92.74 24.29 3.67 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 120.749 0.309 . . . . 0.0 111.282 -173.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.482 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 26.6 m95 -122.17 131.98 54.22 Favored 'General case' 0 C--N 1.295 -1.802 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.527 -177.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.35 135.97 33.12 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 177.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.1 t -98.48 123.3 42.55 Favored 'General case' 0 C--N 1.292 -1.92 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.112 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -130.39 108.15 9.77 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.938 -0.476 . . . . 0.0 110.949 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 59.59 -68.63 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 126.451 1.901 . . . . 0.0 113.642 177.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -147.8 19.66 1.15 Allowed 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.427 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.467 ' HG3' ' HA ' ' A' ' 125' ' ' GLU . 3.9 mppt? -150.87 151.99 33.03 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.231 0.612 . . . . 0.0 109.926 176.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.675 ' SG ' HD11 ' A' ' 126' ' ' LEU . 8.3 m -108.22 136.71 47.43 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 177.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.412 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 13.6 m-85 -113.27 142.0 46.34 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 118.669 0.668 . . . . 0.0 111.546 -176.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . 0.425 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 35.1 t60 -128.15 112.57 14.7 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 175.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.8 t -94.12 98.57 8.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.749 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 4.8 m -77.69 117.86 19.5 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.423 HE22 ' ND2' ' A' ' 62' ' ' ASN . 14.3 mm100 -86.97 14.39 7.46 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.855 0.836 . . . . 0.0 111.726 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.442 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 7.2 m -111.44 156.31 12.61 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.295 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 55.1 m -103.51 158.98 15.98 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -173.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 36.5 m-20 -162.96 170.98 17.25 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 127.716 2.407 . . . . 0.0 107.896 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.7 p -81.64 165.62 20.9 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 170.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -58.42 -50.95 71.86 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.737 0.699 . . . . 0.0 112.051 -174.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 38.6 mt-10 -66.26 -32.01 73.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.596 0.712 . . . . 0.0 110.793 -176.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -70.42 -44.56 67.65 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.454 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.33 -35.22 91.77 Favored Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . 0.441 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 2.7 tm? -55.68 -52.26 64.45 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.77 -35.06 74.27 Favored 'Isoleucine or valine' 0 C--O 1.244 0.778 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.68 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.05 -36.5 81.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.726 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.6 m -67.44 -42.6 82.86 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 176.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.75 -23.11 67.03 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.217 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.96 -33.91 87.12 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.169 176.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -93.94 10.22 34.26 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.284 -0.539 . . . . 0.0 110.056 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 40.85 84.52 Favored Glycine 0 CA--C 1.495 -1.176 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.541 ' HB3' ' O ' ' A' ' 123' ' ' GLN . . . -131.28 176.79 7.99 Favored 'General case' 0 N--CA 1.416 -2.125 0 CA-C-N 114.723 -0.738 . . . . 0.0 109.29 -176.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -117.62 162.14 18.51 Favored 'General case' 0 C--N 1.284 -2.269 0 C-N-CA 123.24 0.616 . . . . 0.0 109.571 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.3 tp -81.1 121.95 26.73 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.8 tpt -21.05 118.42 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 117.291 2.33 . . . . 0.0 117.291 -168.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.459 HD21 ' NE2' ' A' ' 123' ' ' GLN . 3.2 mm? -112.09 105.9 14.39 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.816 1.246 . . . . 0.0 108.127 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.407 ' HB ' ' CH2' ' A' ' 79' ' ' TRP . 24.2 mt -93.73 130.43 42.71 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -175.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -110.08 -26.36 9.73 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.994 176.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -136.96 167.25 21.85 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.291 -173.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -37.55 75.02 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.162 0.985 . . . . 0.0 108.556 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.571 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 6.6 pt-20 -60.3 -27.29 67.19 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-O 121.197 0.522 . . . . 0.0 110.688 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.54 -54.62 33.26 Favored 'General case' 0 N--CA 1.422 -1.842 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.631 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 51.2 mt -68.44 -27.73 66.44 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.571 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 16.5 ptt180 -66.02 -34.81 78.95 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.564 -0.854 . . . . 0.0 108.901 177.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -72.44 -33.69 67.25 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 177.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.644 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -61.11 -49.46 77.21 Favored 'General case' 0 CA--C 1.48 -1.717 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 54.2 mt -56.18 -34.51 66.28 Favored 'General case' 0 C--N 1.314 -0.951 0 O-C-N 123.563 0.539 . . . . 0.0 112.092 -178.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.69 -44.58 85.75 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.86 0.362 . . . . 0.0 110.66 175.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 35.1 p -76.6 -27.55 55.81 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.019 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 53' ' ' LEU . 42.9 mm -66.79 -55.77 16.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.6 tptm 66.05 -63.23 0.24 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.855 1.262 . . . . 0.0 113.492 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -65.52 -39.93 92.37 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 122.69 0.396 . . . . 0.0 111.583 -175.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.452 ' H ' HG22 ' A' ' 57' ' ' ILE . 94.6 mttt 70.99 -47.3 0.65 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 173.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -67.3 -1.0 3.98 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 115.359 1.615 . . . . 0.0 115.359 -170.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 61.7 m-80 -82.04 -160.98 0.4 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.441 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 18.9 m -142.63 114.03 7.85 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 2.7 m-85 -121.61 118.52 29.41 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 117.636 0.198 . . . . 0.0 110.696 -175.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -62.33 142.91 57.54 Favored 'General case' 0 C--N 1.312 -1.048 0 C-N-CA 123.239 0.616 . . . . 0.0 112.018 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.15 176.28 4.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 168.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.57 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.15 47.06 2.55 Favored Glycine 0 C--O 1.217 -0.92 0 CA-C-N 118.71 0.686 . . . . 0.0 114.309 -174.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.9 mt -112.13 118.56 35.69 Favored 'General case' 0 CA--C 1.494 -1.184 0 C-N-CA 123.818 0.847 . . . . 0.0 111.209 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -127.39 136.08 51.36 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.08 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -90.46 112.7 24.43 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 177.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.4 p . . . . . 0 C--N 1.298 -1.667 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.04 -175.184 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 20.1 m120 . . . . . 0 CA--C 1.489 -1.4 0 CA-C-O 120.996 0.427 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -94.01 107.05 19.0 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 171.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -105.28 145.98 29.96 Favored 'General case' 0 C--N 1.275 -2.64 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.807 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.57 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 47.8 m95 -87.25 165.02 15.98 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 176.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 47.0 pt -67.19 -17.83 23.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.541 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 32.7 p-10 -85.9 -9.59 56.68 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.171 0.51 . . . . 0.0 109.742 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.75 8.23 55.95 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.649 -0.705 . . . . 0.0 114.234 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.2 t -85.37 174.8 9.29 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 117.537 0.668 . . . . 0.0 109.911 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 88.0 m -101.18 140.68 35.14 Favored 'General case' 0 N--CA 1.42 -1.944 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.44 HD13 HD13 ' A' ' 92' ' ' ILE . 40.8 tp -53.92 132.56 42.21 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 178.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -92.47 81.86 4.87 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 170.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.4 p -71.74 -11.99 61.09 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.361 0.601 . . . . 0.0 111.19 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -77.34 -1.45 30.0 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.664 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 33.7 m -80.7 -47.69 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.446 174.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.5 mt -154.86 177.79 10.89 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.528 0.731 . . . . 0.0 109.147 -175.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -67.52 117.05 8.94 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -175.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.44 HD13 HD13 ' A' ' 85' ' ' LEU . 8.8 mt -149.86 114.57 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 172.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.7 m -69.88 128.66 37.15 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -81.45 -30.69 35.95 Favored Glycine 0 N--CA 1.418 -2.503 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -174.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -112.7 117.37 32.04 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.5 t -142.73 -19.89 0.67 Allowed 'General case' 0 C--N 1.289 -2.025 0 C-N-CA 119.041 -1.064 . . . . 0.0 111.199 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 49.86 64.77 1.64 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.732 0.777 . . . . 0.0 112.765 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -141.97 167.3 22.46 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.857 -174.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -90.54 29.14 1.34 Allowed 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 126.905 2.082 . . . . 0.0 107.48 175.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' SER . . . . . 0.43 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 21.7 t -91.43 151.24 20.89 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 113.738 -1.574 . . . . 0.0 113.51 -171.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 66.8 m -130.87 151.63 51.08 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 174.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -92.76 149.51 21.25 Favored 'General case' 0 C--O 1.251 1.139 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -173.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.1 148.15 36.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.396 1.078 . . . . 0.0 110.328 -178.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.441 ' O ' ' HA ' ' A' ' 63' ' ' SER . 12.1 mm -77.07 125.61 37.02 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 C-N-CA 124.348 1.059 . . . . 0.0 108.414 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 8.8 t -149.85 95.34 2.3 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 105.51 -143.19 15.65 Favored Glycine 0 C--N 1.296 -1.657 0 N-CA-C 109.083 -1.607 . . . . 0.0 109.083 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -99.03 15.03 27.12 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -128.19 171.3 12.07 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.767 -173.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 10.5 t -104.21 142.46 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.654 0 N-CA-C 105.615 -1.995 . . . . 0.0 105.615 173.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.3 p -131.88 175.73 8.96 Favored 'General case' 0 C--N 1.278 -2.508 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 178.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . 0.43 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 19.4 p90 -138.9 139.04 37.93 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 119.229 0.922 . . . . 0.0 112.743 177.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -125.24 168.5 13.38 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 -177.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.0 m -66.9 136.2 55.01 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 174.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 33.8 m -57.62 -16.88 11.71 Favored 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -173.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -95.41 7.95 44.7 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 123.683 0.793 . . . . 0.0 110.491 -173.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 51.1 p -90.67 140.06 30.13 Favored 'General case' 0 N--CA 1.427 -1.576 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.893 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -75.93 106.5 7.55 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.449 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -141.25 172.22 12.98 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 124.077 0.951 . . . . 0.0 108.684 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.749 ' HB3' ' O ' ' A' ' 21' ' ' SER . 4.7 mpt_? -83.3 -179.68 7.45 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 15.3 p90 -154.56 161.95 41.38 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 118.092 -1.443 . . . . 0.0 112.375 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 82.0 mt -119.83 122.25 68.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.415 0.626 . . . . 0.0 110.282 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 79.4 m -100.46 148.81 24.34 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.955 177.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.541 ' O ' ' HB3' ' A' ' 39' ' ' ALA . 5.4 pt20 -125.98 139.05 53.75 Favored 'General case' 0 N--CA 1.418 -2.028 0 N-CA-C 106.733 -1.581 . . . . 0.0 106.733 172.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -109.51 109.04 19.73 Favored 'General case' 0 C--N 1.259 -3.343 0 N-CA-C 103.699 -2.704 . . . . 0.0 103.699 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . 0.467 ' HA ' ' HG3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -63.72 116.44 5.72 Favored 'General case' 0 N--CA 1.424 -1.747 0 CA-C-O 122.17 0.986 . . . . 0.0 109.406 -176.98 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.675 HD11 ' SG ' ' A' ' 17' ' ' CYS . 12.4 tp . . . . . 0 N--CA 1.415 -2.178 0 CA-C-N 113.923 -1.49 . . . . 0.0 108.188 -170.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mp . . . . . 0 N--CA 1.446 -0.638 0 N-CA-C 105.53 -2.026 . . . . 0.0 105.53 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -115.74 139.34 50.25 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 119.764 1.165 . . . . 0.0 112.25 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.5 m -101.4 157.06 34.39 Favored Pre-proline 0 C--N 1.303 -1.449 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.904 -177.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -64.98 164.18 25.78 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 121.713 1.609 . . . . 0.0 111.667 175.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -49.66 -44.57 47.82 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -176.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -80.83 15.43 1.78 Allowed 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -125.85 153.77 43.64 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.468 -0.77 . . . . 0.0 112.712 -172.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -94.83 -176.69 3.94 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 169.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.5 p -148.22 140.99 24.63 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 120.248 -0.581 . . . . 0.0 111.605 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -148.96 108.31 3.95 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 176.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 70.29 -85.35 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 125.366 1.466 . . . . 0.0 111.524 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -138.52 27.65 2.5 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.789 -174.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.57 157.23 44.01 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 176.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.639 ' SG ' HD11 ' A' ' 126' ' ' LEU . 7.6 m -112.69 140.79 47.17 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -116.63 145.77 43.17 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 118.801 0.728 . . . . 0.0 111.44 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -137.52 106.57 5.99 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.5 t -90.05 101.59 12.39 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.793 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.704 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 5.5 m -78.13 111.17 13.77 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.458 HE22 ' ND2' ' A' ' 62' ' ' ASN . 13.2 mm100 -79.01 14.73 1.3 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.77 0.828 . . . . 0.0 113.027 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.543 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 15.6 m -111.65 156.11 12.84 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 m -102.54 141.9 34.6 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -171.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -152.39 169.73 21.83 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 128.084 2.554 . . . . 0.0 106.842 -179.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 38.2 p -80.45 169.88 17.11 Favored 'General case' 0 C--O 1.253 1.278 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 169.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . 0.408 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 92.9 t90 -57.42 -49.04 77.49 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.743 0.306 . . . . 0.0 111.314 -176.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.05 -35.14 79.21 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.444 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -61.73 -47.77 83.74 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 120.519 0.199 . . . . 0.0 110.715 176.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.4 -35.87 92.63 Favored Glycine 0 CA--C 1.504 -0.631 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.252 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.99 -50.94 72.19 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 96.7 t -64.14 -32.99 59.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.504 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.19 -36.69 84.48 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.945 175.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 60.5 m -68.04 -39.78 83.01 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.43 -33.16 69.39 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 121.162 0.505 . . . . 0.0 109.842 176.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -60.03 -28.3 66.1 Favored Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 114.914 -1.039 . . . . 0.0 113.517 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -99.37 5.8 46.28 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 117.346 0.573 . . . . 0.0 110.302 177.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.5 49.94 41.02 Favored Glycine 0 N--CA 1.44 -1.046 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -174.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.28 177.38 9.05 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -118.88 165.59 13.87 Favored 'General case' 0 C--N 1.29 -2.014 0 C-N-CA 122.623 0.369 . . . . 0.0 110.587 -178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.7 tp -77.54 132.02 38.15 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 18.1 tpt -30.38 121.93 0.19 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -114.39 98.64 7.04 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.8 mt -79.04 123.33 35.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -177.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 71.9 mm-40 -100.36 -20.63 15.75 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 120.055 -0.658 . . . . 0.0 112.45 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.458 ' OD2' ' HB2' ' A' ' 48' ' ' GLU . 21.3 t70 -159.72 169.69 23.14 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -174.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -73.34 -21.32 60.57 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 117.942 0.337 . . . . 0.0 110.781 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.458 ' HB2' ' OD2' ' A' ' 46' ' ' ASP . 0.5 OUTLIER -57.85 -34.41 69.7 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 123.847 0.859 . . . . 0.0 109.109 175.365 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.438 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 3.5 mm-40 -63.16 -55.04 28.54 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.296 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.631 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 79.6 mt -65.8 -24.81 67.0 Favored 'General case' 0 CA--C 1.496 -1.126 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -63.32 -44.93 93.53 Favored 'General case' 0 N--CA 1.402 -2.835 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -73.0 -25.28 60.92 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.654 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.662 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -63.52 -51.39 65.71 Favored 'General case' 0 C--O 1.184 -2.377 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 39.4 mt -51.96 -40.51 60.97 Favored 'General case' 0 C--N 1.311 -1.077 0 O-C-N 123.882 0.739 . . . . 0.0 111.562 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.34 -40.1 95.2 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.092 176.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.3 p -85.61 -9.69 56.93 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.468 0.651 . . . . 0.0 111.793 -179.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.8 mm -83.54 -52.4 13.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.083 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? 68.24 -69.86 0.14 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.209 1.004 . . . . 0.0 112.732 -178.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -59.12 -59.92 4.7 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 123.049 0.539 . . . . 0.0 111.895 -175.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt 75.03 -10.83 1.15 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.81 1.244 . . . . 0.0 112.772 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -77.54 -21.95 51.83 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.682 0.277 . . . . 0.0 111.708 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.582 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 30.2 m-80 -78.84 -169.62 1.84 Allowed 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 15.9 m -140.96 122.97 15.53 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.592 -1.632 . . . . 0.0 106.592 178.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.582 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.8 m-85 -124.5 120.21 31.36 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -174.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -63.57 137.75 58.24 Favored 'General case' 0 C--N 1.311 -1.107 0 O-C-N 123.64 0.587 . . . . 0.0 111.451 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.67 175.13 2.86 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 168.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.583 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.53 44.55 2.25 Favored Glycine 0 C--O 1.216 -0.995 0 CA-C-N 118.792 0.724 . . . . 0.0 114.277 -174.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . 0.474 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 14.9 mt -113.51 123.81 50.9 Favored 'General case' 0 CA--C 1.486 -1.498 0 C-N-CA 124.154 0.981 . . . . 0.0 111.534 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -133.09 144.66 50.13 Favored 'General case' 0 C--N 1.295 -1.786 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.037 171.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -85.15 128.86 34.83 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 177.395 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.5 p . . . . . 0 C--N 1.278 -2.52 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -173.581 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.2 m120 . . . . . 0 N--CA 1.431 -1.407 0 CA-C-O 121.137 0.494 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -103.29 118.47 36.84 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -125.58 157.29 37.52 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.509 177.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.583 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.0 m95 -95.62 165.76 12.17 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.02 -178.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 pt -67.11 -17.03 22.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.489 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 26.7 p-10 -86.26 -15.98 39.05 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.11 8.49 36.09 Favored Glycine 0 C--N 1.317 -0.523 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.665 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.7 m -80.0 162.39 24.91 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 122.617 0.367 . . . . 0.0 111.304 175.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 27.1 m -99.93 140.57 33.96 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . 0.402 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 48.9 tp -68.21 133.21 48.49 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -89.26 91.07 8.62 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 167.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.2 m -70.99 -7.99 50.1 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.599 -177.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -77.75 -4.46 46.45 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.6 m -75.11 -52.95 17.4 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 118.646 -1.221 . . . . 0.0 110.939 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.5 mt -144.29 -178.44 5.97 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -176.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -69.41 111.53 5.35 Favored 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 9.4 mt -146.67 120.18 2.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.239 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 173.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 8.0 m -101.42 138.22 38.71 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 120.631 0.253 . . . . 0.0 110.6 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -95.18 -15.29 45.21 Favored Glycine 0 N--CA 1.432 -1.624 0 N-CA-C 109.864 -1.294 . . . . 0.0 109.864 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -83.03 114.79 21.52 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 174.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.0 t -170.18 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 67.64 17.3 9.89 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -177.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -102.41 -171.33 1.94 Allowed 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -118.31 26.63 9.48 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 105.908 -1.886 . . . . 0.0 105.908 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 32.3 t -66.2 158.87 27.69 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 112.302 -2.226 . . . . 0.0 113.654 -172.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -135.1 154.56 51.63 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 124.831 1.253 . . . . 0.0 108.074 175.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -97.61 150.58 20.98 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -172.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -142.51 146.49 34.75 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 114.633 -1.167 . . . . 0.0 109.926 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.521 ' O ' ' HA ' ' A' ' 63' ' ' SER . 8.7 mm -77.44 126.71 38.13 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 C-N-CA 124.084 0.954 . . . . 0.0 108.585 177.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.2 t -154.36 96.47 1.92 Allowed 'General case' 0 N--CA 1.423 -1.781 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 102.72 -144.18 16.03 Favored Glycine 0 N--CA 1.426 -1.969 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -102.85 22.36 13.94 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 174.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -129.91 169.69 14.88 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 114.171 -1.377 . . . . 0.0 107.81 -174.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 20.9 t -111.86 141.01 28.62 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.13 0 N-CA-C 104.864 -2.272 . . . . 0.0 104.864 172.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.1 p -128.89 171.69 12.05 Favored 'General case' 0 C--N 1.277 -2.58 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 18.8 p90 -149.07 139.85 22.76 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 118.739 0.7 . . . . 0.0 112.257 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -147.27 -176.88 5.4 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.335 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.5 m -72.93 125.48 27.67 Favored 'General case' 0 C--N 1.296 -1.739 0 O-C-N 123.378 0.424 . . . . 0.0 110.328 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 77.4 m -47.03 -23.27 0.44 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 126.803 2.041 . . . . 0.0 114.312 -177.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -83.03 -1.17 51.98 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.83 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.9 p -80.37 154.33 27.79 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 119.946 -0.701 . . . . 0.0 109.674 172.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -94.41 106.21 18.19 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -175.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -137.51 173.97 11.1 Favored 'General case' 0 C--O 1.204 -1.325 0 C-N-CA 123.179 0.592 . . . . 0.0 110.13 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.704 ' HB3' ' O ' ' A' ' 21' ' ' SER . 3.6 mpt_? -81.95 175.51 10.32 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 -177.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 18.9 p90 -149.77 165.81 31.33 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.642 1.11 . . . . 0.0 111.939 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 70.1 mt -124.61 124.88 69.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.356 0.598 . . . . 0.0 110.892 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 95.8 m -102.61 144.2 31.32 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.41 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.427 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 5.7 pt20 -127.48 139.55 52.73 Favored 'General case' 0 N--CA 1.42 -1.95 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 171.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.6 ttmm -110.64 118.25 35.7 Favored 'General case' 0 C--N 1.254 -3.567 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -69.79 118.34 12.52 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 175.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . 0.639 HD11 ' SG ' ' A' ' 17' ' ' CYS . 12.8 tp . . . . . 0 C--N 1.295 -1.793 0 CA-C-N 114.157 -1.383 . . . . 0.0 109.715 -172.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.4 mp . . . . . 0 N--CA 1.441 -0.885 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -87.8 142.92 27.44 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 69.3 m -108.3 162.85 18.45 Favored Pre-proline 0 C--O 1.25 1.087 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.77 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.86 164.81 25.67 Favored 'Trans proline' 0 C--N 1.366 1.481 0 C-N-CA 122.493 2.129 . . . . 0.0 112.584 173.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -56.36 -21.51 25.15 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 125.481 1.512 . . . . 0.0 114.669 -175.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -85.17 -11.49 54.91 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 120.949 0.404 . . . . 0.0 110.411 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 37.4 m95 -113.34 158.93 19.96 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -165.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -99.38 175.96 5.68 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 169.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.7 p -139.9 132.39 28.6 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 118.8 0.727 . . . . 0.0 111.34 -179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' HIS . . . . . 0.454 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 42.8 t-80 -149.57 124.09 9.71 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 122.188 -0.32 . . . . 0.0 111.041 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.501 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 3.0 mmp_? 66.71 -72.58 0.08 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.07 1.348 . . . . 0.0 113.22 175.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -158.98 21.37 0.2 Allowed 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 122.79 0.436 . . . . 0.0 110.511 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LYS . . . . . 0.51 ' HG2' ' NE2' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -145.01 148.1 33.36 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.518 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' CYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 123' ' ' GLN . 8.9 m -95.87 146.58 24.45 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 175.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' PHE . . . . . 0.454 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 22.3 m-85 -117.9 143.12 46.61 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 118.624 0.647 . . . . 0.0 110.522 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -132.25 107.99 8.94 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 69.0 t -89.67 96.03 5.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.741 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 5.0 m -78.08 108.29 11.26 Favored 'General case' 0 N--CA 1.423 -1.786 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -80.09 14.75 1.74 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.437 0.637 . . . . 0.0 112.201 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.47 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 6.0 m -103.13 150.06 6.92 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.881 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.4 m -106.01 141.55 37.2 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -172.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -154.16 174.39 14.8 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 127.906 2.483 . . . . 0.0 107.061 -176.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.0 p -84.55 163.96 19.04 Favored 'General case' 0 C--O 1.255 1.366 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 169.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.9 t90 -53.19 -46.6 69.07 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.139 0.495 . . . . 0.0 111.852 -177.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -64.07 -37.26 86.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.928 -176.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -68.33 -45.44 72.9 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.659 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.92 -34.84 89.08 Favored Glycine 0 CA--C 1.506 -0.502 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.496 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 tt -56.34 -50.99 69.9 Favored 'General case' 0 C--O 1.25 1.092 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 175.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.36 -38.95 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.958 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.47 -40.05 77.71 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 64.6 m -66.26 -39.68 89.63 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.57 -29.26 70.45 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 120.992 0.425 . . . . 0.0 110.838 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.94 -16.59 78.31 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.247 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -92.47 -11.16 35.39 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 177.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.2 31.12 29.14 Favored Glycine 0 N--CA 1.444 -0.825 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 -171.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -129.81 176.98 7.59 Favored 'General case' 0 N--CA 1.42 -1.929 0 CA-C-N 114.755 -0.723 . . . . 0.0 110.096 -174.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' THR . . . . . 0.425 ' HB ' HD11 ' A' ' 80' ' ' ILE . 2.9 p -115.3 157.85 23.21 Favored 'General case' 0 C--N 1.282 -2.329 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.891 178.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.9 tp -66.47 140.68 58.03 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 173.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.3 tpt -39.31 120.75 1.07 Allowed 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -171.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.1 tp -121.04 90.52 3.34 Favored 'General case' 0 N--CA 1.434 -1.265 0 N-CA-C 106.427 -1.694 . . . . 0.0 106.427 -175.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ILE . . . . . 0.422 HD11 HD13 ' A' ' 50' ' ' LEU . 44.4 mt -67.61 122.74 19.34 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.019 -171.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -92.9 -21.85 19.59 Favored 'General case' 0 CA--C 1.552 1.058 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.984 -176.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ASP . . . . . 0.595 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 28.3 t70 -173.08 177.64 2.69 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -171.09 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -78.65 -31.06 46.67 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.576 -0.702 . . . . 0.0 111.274 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.37 -30.23 66.62 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 124.052 0.941 . . . . 0.0 108.59 176.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLU . . . . . 0.595 ' HB2' ' O ' ' A' ' 46' ' ' ASP . 4.3 mm-40 -61.24 -56.27 22.52 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.429 174.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 79.5 mt -69.58 -28.47 66.0 Favored 'General case' 0 CA--C 1.48 -1.716 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -175.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.4 ptt180 -69.97 -34.19 73.05 Favored 'General case' 0 N--CA 1.421 -1.905 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.147 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -73.77 -28.28 61.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 175.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.642 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.0 mm? -61.47 -49.36 77.09 Favored 'General case' 0 C--O 1.182 -2.468 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 173.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 37.9 mt -55.35 -35.4 65.18 Favored 'General case' 0 C--N 1.313 -0.996 0 O-C-N 123.236 0.335 . . . . 0.0 111.351 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -68.12 -42.59 79.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.073 176.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.2 p -79.51 -24.52 42.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -178.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.642 HG12 ' O ' ' A' ' 53' ' ' LEU . 36.4 mm -65.84 -51.36 62.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 174.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 49.6 tptt 72.6 -65.67 0.34 Allowed 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.06 0.944 . . . . 0.0 113.472 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -65.06 -55.32 19.55 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 118.633 0.652 . . . . 0.0 112.429 -176.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.441 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 44.5 mtmt 69.44 21.34 6.9 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.429 0.692 . . . . 0.0 110.369 -177.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -120.17 19.7 12.17 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.272 0.558 . . . . 0.0 110.852 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASN . . . . . 0.527 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 41.9 m-80 -124.47 -153.8 0.58 Allowed 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' SER . . . . . 0.587 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 5.6 t -149.8 126.97 11.31 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 175.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' PHE . . . . . 0.527 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.1 m-85 -129.57 113.37 14.74 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -175.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -57.63 136.76 56.84 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 124.085 0.954 . . . . 0.0 112.29 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -120.68 176.71 3.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 170.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLY . . . . . 0.59 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -78.19 56.63 4.02 Favored Glycine 0 C--O 1.204 -1.775 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.814 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.7 mt -125.03 121.07 33.3 Favored 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 122.998 0.519 . . . . 0.0 111.718 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 30.0 ptt180 -128.3 135.42 49.59 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.084 176.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -81.33 113.5 19.48 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.4 p . . . . . 0 C--N 1.3 -1.583 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.848 -174.002 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 17.2 m120 . . . . . 0 N--CA 1.431 -1.387 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -100.82 122.42 43.4 Favored 'General case' 0 C--N 1.288 -2.074 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -116.82 147.2 42.33 Favored 'General case' 0 C--N 1.291 -1.964 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.183 178.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' TRP . . . . . 0.59 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 16.1 m95 -91.0 178.14 6.09 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 123.951 0.782 . . . . 0.0 109.504 -177.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . 0.425 HD11 ' HB ' ' A' ' 40' ' ' THR . 48.6 pt -73.06 -12.46 15.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.028 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ASN . . . . . 0.489 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 31.5 p-10 -95.55 -0.91 51.52 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.802 0.81 . . . . 0.0 109.021 178.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.1 5.58 76.51 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 114.5 -1.227 . . . . 0.0 113.563 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.9 t -81.83 169.4 16.92 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -178.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.2 m -100.04 142.9 30.9 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.9 tp -54.57 138.87 39.88 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 124.63 1.172 . . . . 0.0 113.233 176.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ASN . . . . . 0.453 ' OD1' HG11 ' A' ' 89' ' ' VAL . 25.9 t-20 -93.57 86.52 5.22 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 170.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 p -73.08 3.83 5.05 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -77.57 -21.78 51.97 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.463 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.453 HG11 ' OD1' ' A' ' 86' ' ' ASN . 32.9 m -78.56 -55.24 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 C-N-CA 120.156 -0.617 . . . . 0.0 112.367 -178.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.4 mt -140.29 170.37 15.95 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -175.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.482 ' O ' HG12 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -72.97 123.19 23.0 Favored 'General case' 0 CA--C 1.5 -0.963 0 O-C-N 123.876 0.735 . . . . 0.0 112.632 -175.828 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 91' ' ' LYS . 2.4 mt -152.32 99.47 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 N-CA-C 104.733 -2.321 . . . . 0.0 104.733 174.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 5.3 m -66.8 136.69 55.84 Favored 'General case' 0 C--N 1.285 -2.21 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.553 -173.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -102.0 26.34 24.68 Favored Glycine 0 CA--C 1.479 -2.203 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -175.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -152.44 130.63 11.96 Favored 'General case' 0 N--CA 1.409 -2.515 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 174.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.4 t -169.93 -31.62 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.596 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 65.81 28.54 10.84 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.448 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -105.57 178.63 4.51 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.877 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -96.81 27.75 3.8 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.0 p -63.31 150.35 43.49 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 113.004 -1.907 . . . . 0.0 115.797 -171.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -134.03 147.53 50.97 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 113.444 -1.707 . . . . 0.0 106.688 173.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.48 151.56 19.27 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -172.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -146.71 147.37 30.9 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.849 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' ILE . . . . . 0.587 ' O ' ' HA ' ' A' ' 63' ' ' SER . 11.5 mm -76.95 131.06 35.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 107.397 -1.335 . . . . 0.0 107.397 177.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 27.9 t -106.68 -71.23 0.76 Allowed 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 175.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' GLY . . . . . 0.441 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . -124.98 -102.22 1.39 Allowed Glycine 0 N--CA 1.413 -2.893 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 178.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -98.64 2.47 47.29 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -125.51 162.74 24.22 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.034 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.8 t -99.37 136.82 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.419 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 174.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.3 p -125.39 166.47 16.51 Favored 'General case' 0 C--N 1.269 -2.917 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.8 p90 -138.85 134.15 32.94 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 118.927 0.785 . . . . 0.0 112.848 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -132.24 179.58 6.03 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.491 -1.231 . . . . 0.0 108.406 -176.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.4 m -78.31 129.22 34.77 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 174.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.6 m -48.21 -18.94 0.24 Allowed 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 126.591 1.956 . . . . 0.0 115.038 -176.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -86.37 -3.99 59.09 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 123.525 0.73 . . . . 0.0 110.559 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.0 p -77.43 149.59 35.1 Favored 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 119.965 -0.694 . . . . 0.0 111.069 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -86.39 93.8 9.21 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.989 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -128.35 174.45 9.3 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 114.804 -1.089 . . . . 0.0 108.523 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ARG . . . . . 0.741 ' HB3' ' O ' ' A' ' 21' ' ' SER . 2.5 mpt_? -93.37 -174.5 3.53 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 -177.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' TRP . . . . . 0.41 ' CH2' HG23 ' A' ' 23' ' ' VAL . 28.8 p90 -152.21 167.56 28.19 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.864 1.211 . . . . 0.0 111.95 -179.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 69.9 mt -125.59 129.85 72.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.451 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 75.0 m -110.03 150.98 27.75 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' GLN . . . . . 0.556 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.3 pt20 -128.25 140.64 51.78 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 171.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -117.27 115.16 24.74 Favored 'General case' 0 C--N 1.277 -2.556 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -74.95 120.69 20.82 Favored 'General case' 0 C--N 1.286 -2.156 0 CA-C-O 121.362 0.601 . . . . 0.0 111.803 -174.24 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.8 mm? . . . . . 0 CA--C 1.504 -0.814 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.075 179.3 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.554 ' HB2' ' OD1' ' A' ' 15' ' ' ASP . 14.1 m . . . . . 0 N--CA 1.441 -0.899 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.97 7.69 39.1 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -173.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . 0.251 6.3 tmtt? 69.25 139.31 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 179.626 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.433 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 6.0 mp -97.3 175.85 6.12 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 176.647 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -79.49 143.38 34.96 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -174.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.652 ' SG ' ' HD2' ' A' ' 7' ' ' PRO . 49.0 t -137.37 156.2 75.27 Favored Pre-proline 0 C--N 1.306 -1.293 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.652 ' HD2' ' SG ' ' A' ' 6' ' ' CYS . 81.7 Cg_exo -48.78 153.22 3.79 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 122.843 2.362 . . . . 0.0 112.814 176.583 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -59.95 -29.37 68.37 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -171.077 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -78.43 -10.84 59.86 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.295 0.569 . . . . 0.0 111.226 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.471 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 26.9 m95 -95.63 117.03 29.71 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.041 -173.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -72.72 122.04 20.83 Favored 'General case' 0 CA--C 1.497 -1.066 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -176.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.0 p -92.7 128.52 38.58 Favored 'General case' 0 N--CA 1.41 -2.428 0 CA-C-O 122.355 1.074 . . . . 0.0 113.556 -174.014 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 25.5 t60 -138.41 154.78 48.9 Favored 'General case' 0 C--O 1.2 -1.531 0 C-N-CA 126.973 2.109 . . . . 0.0 105.839 -177.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -11.89 83.98 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.998 0 C-N-CA 125.78 1.632 . . . . 0.0 114.586 175.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.554 ' OD1' ' HB2' ' A' ' 1' ' ' SER . 18.9 m-20 60.74 23.53 13.42 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.801 1.641 . . . . 0.0 114.617 173.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.596 ' HE2' ' OE1' ' A' ' 49' ' ' GLU . 13.0 mtpp -148.86 142.58 25.56 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.849 ' SG ' ' HB3' ' A' ' 124' ' ' LYS . 19.4 p -123.9 139.28 54.11 Favored 'General case' 0 C--N 1.287 -2.116 0 O-C-N 121.511 -0.743 . . . . 0.0 109.807 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.412 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 17.5 m-85 -116.87 140.51 49.37 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -171.261 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -115.56 106.64 14.16 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.1 t -87.42 92.47 3.81 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.751 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.1 m -77.26 114.56 16.2 Favored 'General case' 0 N--CA 1.423 -1.804 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.354 -176.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.542 ' C ' ' HG2' ' A' ' 119' ' ' ARG . 9.2 mm100 -83.86 13.92 4.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.755 0.822 . . . . 0.0 112.663 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.467 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.8 m -109.63 150.09 12.43 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 178.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.0 m -98.24 152.8 19.01 Favored 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -173.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.9 m-20 -154.43 -176.92 6.12 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 127.506 2.322 . . . . 0.0 106.687 178.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 61.3 p -91.81 168.34 11.52 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 168.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 92.0 t90 -58.35 -53.83 53.87 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.593 0.633 . . . . 0.0 112.289 -175.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.482 ' O ' HG21 ' A' ' 32' ' ' VAL . 42.9 mt-10 -64.93 -31.93 73.41 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.307 0.575 . . . . 0.0 110.416 -177.239 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -71.45 -42.15 68.56 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.124 -0.943 . . . . 0.0 110.594 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.57 -33.88 87.51 Favored Glycine 0 CA--C 1.501 -0.843 0 N-CA-C 110.859 -0.896 . . . . 0.0 110.859 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 tt -59.91 -46.86 88.01 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 176.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.482 HG21 ' O ' ' A' ' 28' ' ' GLU . 90.1 t -61.87 -36.68 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.274 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -61.26 -36.76 80.9 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.845 175.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.0 m -71.51 -40.07 70.38 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -55.98 -39.7 72.2 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -56.17 -34.41 62.54 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 114.943 -1.026 . . . . 0.0 114.434 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -89.76 -5.3 57.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.51 0.655 . . . . 0.0 111.507 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.06 51.91 5.98 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 107.753 -2.139 . . . . 0.0 107.753 -171.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.01 178.04 8.5 Favored 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.2 p -123.14 158.48 30.62 Favored 'General case' 0 C--N 1.281 -2.409 0 C-N-CA 122.765 0.426 . . . . 0.0 110.936 -177.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.1 tp -76.15 130.48 38.33 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 174.507 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.2 tpt -30.03 120.53 0.17 Allowed 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 117.264 2.32 . . . . 0.0 117.264 -169.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -109.1 110.95 22.32 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 124.704 1.201 . . . . 0.0 108.007 177.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.482 ' HB ' ' CH2' ' A' ' 79' ' ' TRP . 37.8 mt -98.68 132.84 43.1 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -175.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 56.0 tp60 -105.84 -44.27 4.67 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 120.868 0.365 . . . . 0.0 111.464 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -137.57 178.13 7.34 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -172.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -81.04 -19.42 43.88 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 122.049 -0.407 . . . . 0.0 110.362 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.495 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 51.9 mt-10 -57.91 -33.23 68.54 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.699 0.762 . . . . 0.0 109.788 173.495 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.596 ' OE1' ' HE2' ' A' ' 16' ' ' LYS . 10.2 mm-40 -64.89 -55.36 19.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.671 -1.15 . . . . 0.0 107.995 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.506 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 63.4 mt -68.96 -25.15 64.4 Favored 'General case' 0 CA--C 1.496 -1.13 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -176.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.495 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 34.7 ptt180 -68.93 -33.73 74.21 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.363 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -73.72 -28.21 61.59 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.666 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.4 mm? -63.75 -48.83 75.4 Favored 'General case' 0 C--O 1.176 -2.805 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.506 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 43.7 mt -54.76 -34.11 62.15 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -67.35 -46.74 72.51 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.953 0.406 . . . . 0.0 111.444 172.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.8 p -81.17 -20.88 40.27 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -174.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.666 HG12 ' O ' ' A' ' 53' ' ' LEU . 16.6 mm -56.24 -45.97 81.27 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 C-N-CA 123.817 0.847 . . . . 0.0 111.031 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? 69.86 -63.69 0.38 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.024 0.929 . . . . 0.0 112.798 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.87 -56.34 6.5 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -175.306 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.424 ' C ' ' H ' ' A' ' 62' ' ' ASN . 91.4 mttt 74.06 -38.57 0.4 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.175 0.99 . . . . 0.0 113.669 -176.486 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -82.3 28.85 0.44 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.879 0.847 . . . . 0.0 111.707 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.424 ' H ' ' C ' ' A' ' 60' ' ' LYS . 53.4 m-80 -132.6 -173.99 3.33 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.026 177.167 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.596 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 13.3 m -137.63 133.09 33.93 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.055 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.469 ' HA ' ' O ' ' A' ' 119' ' ' ARG . 1.0 OUTLIER -131.47 118.62 20.44 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -175.556 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -59.99 135.95 57.87 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 123.357 0.663 . . . . 0.0 112.038 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.59 176.21 2.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 N-CA-C 106.6 -1.629 . . . . 0.0 106.6 169.527 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.532 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.28 40.44 1.73 Allowed Glycine 0 C--O 1.22 -0.763 0 CA-C-N 118.89 0.768 . . . . 0.0 114.59 -174.093 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.56 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 20.5 mt -101.93 115.51 30.7 Favored 'General case' 0 CA--C 1.488 -1.422 0 C-N-CA 123.191 0.596 . . . . 0.0 111.637 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 28.4 ptt180 -122.02 137.22 54.88 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.104 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -91.11 113.69 26.02 Favored 'General case' 0 C--N 1.287 -2.137 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.448 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 22.7 p -94.83 116.88 29.27 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -174.129 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 50.5 mt -119.97 144.02 36.61 Favored Pre-proline 0 C--N 1.309 -1.16 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.168 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -85.7 126.76 9.86 Favored 'Cis proline' 0 N--CA 1.446 -1.312 0 C-N-CA 123.493 -1.461 . . . . 0.0 111.78 -0.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.448 ' HB3' ' O ' ' A' ' 71' ' ' THR . 13.4 t70 175.77 -42.87 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 124.113 0.965 . . . . 0.0 109.155 -174.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 45.4 mtm 71.49 11.83 6.55 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 176.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.403 ' HB2' ' OD2' ' A' ' 74' ' ' ASP . 16.3 m120 -106.14 154.88 20.05 Favored 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.052 172.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -88.92 125.72 35.07 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.371 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -118.9 158.84 24.91 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.121 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.56 ' CZ3' ' HG ' ' A' ' 68' ' ' LEU . 62.4 m95 -96.19 176.32 6.12 Favored 'General case' 0 C--N 1.277 -2.572 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.185 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.4 pt -73.36 -23.34 19.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 CA-C-O 121.01 0.433 . . . . 0.0 111.362 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.441 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 29.6 p-10 -83.3 -16.32 46.68 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.3 8.49 35.64 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.435 -0.802 . . . . 0.0 113.081 175.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.8 m -75.65 170.52 16.01 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 175.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 20.7 m -102.54 139.68 37.82 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 42.0 tp -62.98 142.36 58.39 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 176.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -95.7 86.8 4.5 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.6 p -71.09 -8.23 52.02 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -176.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -77.94 -14.12 59.64 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 27.7 m -75.76 -49.66 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.828 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.0 mt -147.69 -179.01 6.57 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 -173.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 99.87 1.74 Allowed 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.041 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 8.0 mt -140.51 96.67 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 172.304 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.3 m -62.24 124.67 21.48 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.884 -178.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -85.69 -41.49 7.24 Favored Glycine 0 N--CA 1.41 -3.059 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -94.29 88.37 5.54 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-O 121.82 0.819 . . . . 0.0 110.971 178.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.8 t -126.39 -32.43 2.68 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.536 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 60.83 36.99 18.91 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.303 0.641 . . . . 0.0 111.383 176.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.409 ' C ' ' H ' ' A' ' 100' ' ' SER . 40.7 m-80 -116.99 177.82 4.57 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 179.731 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -81.58 27.69 0.43 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 126.167 1.787 . . . . 0.0 109.372 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.409 ' H ' ' C ' ' A' ' 98' ' ' ASN . 13.9 m -72.85 142.62 47.97 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -170.033 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 61.6 m -133.06 146.28 51.54 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 103.944 -2.613 . . . . 0.0 103.944 166.075 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -99.81 153.14 19.37 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -172.193 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.29 148.43 36.33 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.61 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.596 ' O ' ' HA ' ' A' ' 63' ' ' SER . 11.0 mm -78.13 128.4 38.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.483 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 175.02 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.1 t -140.42 90.17 2.34 Favored 'General case' 0 N--CA 1.408 -2.529 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 89.0 -126.65 8.3 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.25 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -101.86 8.55 41.23 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 176.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -119.13 167.21 12.02 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.814 -175.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 14.2 t -115.75 134.24 59.63 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 N-CA-C 104.682 -2.34 . . . . 0.0 104.682 173.265 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 69.7 p -124.97 170.07 11.48 Favored 'General case' 0 C--N 1.267 -2.988 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 25.4 p90 -148.46 142.04 25.45 Favored 'General case' 0 C--N 1.298 -1.666 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.421 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -154.69 178.69 9.83 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.815 -176.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.3 m -54.07 124.53 15.9 Favored 'General case' 0 N--CA 1.443 -0.817 0 O-C-N 124.132 0.895 . . . . 0.0 108.992 176.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 8.4 m -53.57 -22.88 9.27 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.491 1.117 . . . . 0.0 112.635 -174.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -80.43 -2.06 44.15 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.09 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 24.9 p -74.47 136.58 42.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 119.236 0.925 . . . . 0.0 112.608 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.79 101.42 0.26 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.328 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . 0.52 ' OD1' ' HB2' ' A' ' 63' ' ' SER . 47.3 m-80 -142.58 158.98 43.1 Favored 'General case' 0 CA--C 1.485 -1.539 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.209 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.751 ' HB3' ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.57 178.68 6.49 Favored 'General case' 0 C--N 1.292 -1.925 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.093 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 18.4 p90 -152.36 167.14 29.65 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 118.733 -1.187 . . . . 0.0 112.36 -174.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 82.6 mt -125.29 118.28 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 CA-C-O 121.625 0.726 . . . . 0.0 110.712 179.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 90.7 m -97.02 140.87 30.89 Favored 'General case' 0 C--N 1.287 -2.135 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.758 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.466 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 5.0 pt20 -120.12 137.86 53.91 Favored 'General case' 0 N--CA 1.415 -2.213 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 173.553 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.849 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 22.8 ttmm -110.95 110.91 21.69 Favored 'General case' 0 C--N 1.258 -3.374 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 171.113 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -83.54 124.0 30.31 Favored 'General case' 0 N--CA 1.406 -2.63 0 C-N-CA 119.621 -0.832 . . . . 0.0 108.767 -175.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.433 ' HG ' ' H ' ' A' ' 4' ' ' LEU . 1.8 mm? -68.2 -21.12 64.88 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.255 -177.117 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' TYR . . . . . 0.409 ' HD1' ' HB3' ' A' ' 15' ' ' ASP . 32.6 m-85 -111.88 85.54 2.16 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.125 173.219 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 8.9 p-80 -109.48 -10.05 14.9 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.93 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -99.06 17.62 19.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.783 177.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 2.6 m -61.14 -70.2 0.2 Allowed 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 123.16 0.584 . . . . 0.0 111.116 -177.472 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.1 mt -130.55 105.52 7.9 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.9 m -87.75 -40.88 13.72 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 176.657 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 68.52 155.71 0.12 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.947 177.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 65.94 163.28 0.16 Allowed 'General case' 0 C--O 1.242 0.687 0 C-N-CA 125.287 1.435 . . . . 0.0 113.541 175.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 22.3 t -115.55 23.14 5.48 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.273 0 N-CA-C 104.914 -2.254 . . . . 0.0 104.914 172.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 117.54 -82.28 0.33 Allowed Glycine 0 N--CA 1.422 -2.283 0 N-CA-C 108.315 -1.914 . . . . 0.0 108.315 -173.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -143.08 -55.25 0.41 Allowed 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 145.6 56.45 0.02 OUTLIER Glycine 0 N--CA 1.427 -1.934 0 N-CA-C 109.971 -1.251 . . . . 0.0 109.971 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 75.8 t60 . . . . . 0 C--N 1.308 -1.198 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.215 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 C--O 1.245 0.855 0 CA-C-O 120.866 0.365 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.92 91.4 5.99 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.457 ' HB3' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -78.32 165.82 23.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.322 0.582 . . . . 0.0 111.871 -178.398 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.419 ' N ' HD13 ' A' ' 4' ' ' LEU . 4.7 mp -97.91 -160.51 0.81 Allowed 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 114.926 -1.034 . . . . 0.0 108.614 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -94.38 135.05 36.24 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.577 -176.557 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.405 ' HB3' HD11 ' A' ' 126' ' ' LEU . 8.8 p -128.58 166.41 24.76 Favored Pre-proline 0 C--N 1.296 -1.738 0 C-N-CA 124.089 0.956 . . . . 0.0 108.501 177.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -61.42 156.91 43.66 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 121.641 1.561 . . . . 0.0 113.155 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -42.64 -48.64 5.51 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 116.299 1.963 . . . . 0.0 116.299 -175.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -83.76 7.15 18.68 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -172.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.415 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 60.1 m95 -104.4 121.45 43.42 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 121.232 0.539 . . . . 0.0 110.711 -177.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.503 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 4.8 mp -75.92 106.51 7.54 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 124.843 1.257 . . . . 0.0 111.063 -176.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.1 p -74.66 114.44 13.08 Favored 'General case' 0 C--N 1.276 -2.625 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.794 -176.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -138.93 125.72 20.9 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 123.999 0.919 . . . . 0.0 109.413 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.457 ' O ' ' HB3' ' A' ' 3' ' ' LYS . 72.3 mtt180 57.93 -88.61 0.02 OUTLIER 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.544 ' HB2' ' CD1' ' A' ' 127' ' ' TYR . 10.0 p-10 -144.69 25.31 1.48 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.499 0.666 . . . . 0.0 110.112 -177.024 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.36 151.7 36.96 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 178.703 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.596 ' SG ' HD23 ' A' ' 126' ' ' LEU . 80.8 m -116.34 140.36 49.42 Favored 'General case' 0 C--N 1.275 -2.631 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.057 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -110.82 141.67 43.86 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.206 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -119.24 108.17 14.31 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 173.757 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.0 t -89.18 95.05 5.13 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.68 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.8 m -77.97 115.19 17.52 Favored 'General case' 0 N--CA 1.417 -2.085 0 CA-C-N 115.328 -0.851 . . . . 0.0 108.725 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.547 HE22 ' ND2' ' A' ' 62' ' ' ASN . 12.0 mm100 -87.82 13.75 10.08 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.956 0.902 . . . . 0.0 111.255 -178.424 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.8 m -107.65 156.48 8.12 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 37.7 m -91.77 156.74 17.33 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -173.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.1 m-20 -170.88 170.75 6.28 Favored 'General case' 0 CA--C 1.502 -0.876 0 C-N-CA 127.414 2.286 . . . . 0.0 107.912 175.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.5 p -85.02 166.02 17.06 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 172.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.468 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 88.9 t90 -56.48 -53.26 59.54 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -174.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.436 ' O ' HG22 ' A' ' 32' ' ' VAL . 37.9 mt-10 -63.92 -32.29 73.77 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.942 0.877 . . . . 0.0 110.556 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -73.91 -44.28 55.68 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.46 -1.245 . . . . 0.0 110.412 -175.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.12 -34.63 90.49 Favored Glycine 0 C--O 1.221 -0.682 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 174.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 tt -58.86 -51.17 71.14 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.436 HG22 ' O ' ' A' ' 28' ' ' GLU . 87.6 t -59.3 -38.21 73.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.502 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.89 -36.64 84.59 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.98 -0.555 . . . . 0.0 112.103 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 81.3 m -66.34 -43.47 86.02 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -57.23 -29.88 64.13 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.577 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -56.92 -34.91 66.33 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.933 179.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -101.44 11.57 38.89 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.78 14.07 82.93 Favored Glycine 0 C--O 1.245 0.794 0 CA-C-O 121.625 0.57 . . . . 0.0 111.763 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -104.69 166.16 10.58 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -175.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.2 p -110.01 160.57 16.32 Favored 'General case' 0 C--N 1.28 -2.441 0 O-C-N 122.175 -0.328 . . . . 0.0 110.626 -179.141 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -75.52 124.69 27.61 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.3 tpt -24.72 120.09 0.05 Allowed 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 -170.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -110.55 105.45 14.39 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 124.845 1.258 . . . . 0.0 107.62 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.451 HD13 HD11 ' A' ' 50' ' ' LEU . 34.2 mt -86.22 105.81 15.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -176.162 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -90.27 -22.69 21.47 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.731 -176.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.509 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 15.9 t70 -149.64 163.9 36.63 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -170.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -35.22 80.32 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 176.253 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -60.56 -27.83 67.97 Favored 'General case' 0 CA--C 1.499 -0.983 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.509 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 13.3 mm-40 -57.54 -55.79 30.26 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.644 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 61.6 mt -71.88 -25.78 62.07 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -177.508 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -62.88 -38.01 89.2 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -68.06 -37.0 80.79 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.679 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.5 mm? -62.48 -53.17 58.81 Favored 'General case' 0 C--O 1.206 -1.193 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 60.3 mt -56.49 -34.59 67.1 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -177.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -73.56 -41.91 62.32 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 176.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.3 p -81.4 -34.98 31.26 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.679 HG12 ' O ' ' A' ' 53' ' ' LEU . 51.0 mm -57.12 -45.73 84.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 CA-C-O 121.244 0.545 . . . . 0.0 109.655 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 52.0 tptt 68.96 -56.79 0.53 Allowed 'General case' 0 C--O 1.24 0.588 0 C-N-CA 124.895 1.278 . . . . 0.0 112.858 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -62.26 -52.18 64.75 Favored 'General case' 0 C--O 1.207 -1.156 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.48 ' C ' ' H ' ' A' ' 62' ' ' ASN . 97.6 mttt 73.86 -47.98 0.66 Allowed 'General case' 0 C--O 1.205 -1.27 0 C-N-CA 124.98 1.312 . . . . 0.0 112.712 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -70.21 27.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.168 1.387 . . . . 0.0 114.058 -174.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.547 ' ND2' HE22 ' A' ' 22' ' ' GLN . 77.6 m-20 -115.29 -171.18 1.91 Allowed 'General case' 0 C--N 1.286 -2.186 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 176.345 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.652 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 14.0 m -144.82 119.3 9.67 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.517 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.5 m-85 -124.33 123.47 40.27 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -176.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.519 ' CE2' ' HB2' ' A' ' 118' ' ' ASN . 78.0 m95 -62.17 138.86 58.47 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 123.182 0.593 . . . . 0.0 110.616 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -118.45 174.67 4.11 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 169.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.599 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.41 47.52 2.39 Favored Glycine 0 C--O 1.21 -1.386 0 CA-C-N 118.728 0.695 . . . . 0.0 114.817 -173.805 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.495 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 17.3 mt -113.4 120.01 39.61 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 123.451 0.701 . . . . 0.0 111.901 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -126.4 140.38 52.53 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.291 176.565 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -91.06 124.5 35.34 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.436 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 35.5 p -105.97 117.86 35.11 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -175.397 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 57.6 mt -120.51 143.72 36.78 Favored Pre-proline 0 N--CA 1.439 -0.977 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 174.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.54 126.62 11.24 Favored 'Cis proline' 0 C--O 1.243 0.772 0 C-N-CA 123.365 -1.515 . . . . 0.0 110.92 -4.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.436 ' HB3' ' O ' ' A' ' 71' ' ' THR . 12.9 t70 -177.7 -39.12 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 -176.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 4.6 mpp? 67.15 16.33 10.21 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.568 1.547 . . . . 0.0 114.488 176.552 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -118.37 159.74 22.9 Favored 'General case' 0 C--O 1.258 1.509 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.114 173.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 66.8 m95 -97.41 134.41 40.71 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -126.79 151.97 47.55 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.683 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.599 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 37.0 m95 -93.63 169.93 9.96 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 38.6 pt -69.38 -20.42 24.13 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -177.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.439 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 31.3 p-10 -85.05 -14.14 48.24 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.655 0.741 . . . . 0.0 109.286 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.98 8.41 36.55 Favored Glycine 0 N--CA 1.443 -0.894 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.363 176.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.8 m -74.97 163.42 27.64 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.032 0.444 . . . . 0.0 111.692 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 19.9 m -98.96 140.4 33.16 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 176.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.442 HD11 HD12 ' A' ' 92' ' ' ILE . 43.5 tp -54.64 143.86 23.57 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -100.87 95.73 6.82 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 170.149 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.0 m -71.39 -11.28 60.81 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.123 0.487 . . . . 0.0 111.814 -175.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -78.14 -12.49 60.0 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -176.325 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 29.2 m -75.3 -54.2 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 C-N-CA 119.079 -1.048 . . . . 0.0 112.473 -177.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.5 mt -152.03 -178.29 6.68 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -177.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -68.33 111.88 4.87 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -176.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.442 HD12 HD11 ' A' ' 85' ' ' LEU . 9.7 mt -145.97 105.44 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 174.314 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.0 m -61.06 128.99 39.16 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 123.021 0.529 . . . . 0.0 109.899 -179.169 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -84.33 -53.33 3.3 Favored Glycine 0 N--CA 1.418 -2.516 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 -176.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -93.23 82.56 4.53 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-O 122.767 1.27 . . . . 0.0 110.536 176.354 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.6 t -100.69 -24.01 14.51 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.587 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 63.46 17.63 10.47 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.609 0.764 . . . . 0.0 112.218 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -111.32 -178.68 3.51 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -86.67 26.93 1.03 Allowed 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 126.654 1.982 . . . . 0.0 109.798 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 m -72.1 150.72 43.63 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 116.619 2.081 . . . . 0.0 116.619 -170.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -143.45 148.78 36.63 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 166.562 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -98.09 153.81 18.17 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -169.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.25 150.2 38.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.376 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.652 ' O ' ' HA ' ' A' ' 63' ' ' SER . 17.5 mm -77.82 112.11 15.41 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.532 0 N-CA-C 106.627 -1.619 . . . . 0.0 106.627 173.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.531 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 8.8 t -134.04 100.6 4.77 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 98.62 -134.43 11.69 Favored Glycine 0 C--N 1.276 -2.79 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -100.15 0.98 41.63 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -128.77 -176.66 3.91 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.315 -172.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.2 t -105.88 135.41 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.548 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 71.2 p -131.32 175.08 9.43 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 106.406 -1.701 . . . . 0.0 106.406 176.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -146.5 156.91 43.61 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 119.94 1.245 . . . . 0.0 113.307 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -161.3 -176.38 5.37 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.362 1.065 . . . . 0.0 109.67 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 17.5 t -68.66 128.38 36.42 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 176.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 79.5 m -50.62 -12.93 0.11 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 126.045 1.738 . . . . 0.0 115.202 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -100.97 3.66 41.81 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.279 -168.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.5 p -85.81 172.65 10.62 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 121.593 0.711 . . . . 0.0 111.522 177.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.54 123.07 26.68 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.227 175.974 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . 0.519 ' HB2' ' CE2' ' A' ' 65' ' ' TRP . 74.5 m-20 -158.88 172.73 17.68 Favored 'General case' 0 CA--C 1.488 -1.439 0 C-N-CA 125.092 1.357 . . . . 0.0 107.421 172.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.68 ' HB3' ' O ' ' A' ' 21' ' ' SER . 2.2 mpt_? -100.96 -169.92 1.77 Allowed 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 178.631 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 16.0 p90 -154.41 160.99 41.95 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.663 1.574 . . . . 0.0 112.573 -177.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 75.3 mt -120.83 125.54 74.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.941 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 72.2 m -106.17 146.9 29.66 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.109 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -123.77 133.91 53.75 Favored 'General case' 0 N--CA 1.425 -1.718 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 173.453 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.7 tttm -109.81 109.21 19.8 Favored 'General case' 0 C--N 1.272 -2.763 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.35 124.23 28.68 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 121.353 0.597 . . . . 0.0 110.69 -172.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.596 HD23 ' SG ' ' A' ' 17' ' ' CYS . 2.9 mm? -75.82 -18.97 59.28 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.091 -178.271 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' TYR . . . . . 0.544 ' CD1' ' HB2' ' A' ' 15' ' ' ASP . 7.6 m-85 -94.87 22.99 5.86 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.045 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -61.96 -37.62 85.44 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 175.61 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -102.54 94.9 5.9 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 171.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 17.5 m -88.05 -30.94 19.55 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 179.015 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -120.36 130.26 54.32 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 66.0 m -88.95 89.32 7.94 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 172.562 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -65.31 -58.22 6.46 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.971 -174.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 60.4 t80 66.96 -0.92 1.53 Allowed 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.708 178.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 31.9 t 67.91 17.94 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 CA-C-O 123.05 1.405 . . . . 0.0 108.121 -173.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -88.54 85.51 1.46 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 110.089 -1.204 . . . . 0.0 110.089 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -105.17 10.71 33.71 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 121.782 0.801 . . . . 0.0 109.141 -177.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 171.1 -49.25 0.19 Allowed Glycine 0 N--CA 1.428 -1.89 0 N-CA-C 109.262 -1.535 . . . . 0.0 109.262 -177.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 . . . . . 0 C--N 1.312 -1.029 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 176.412 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.1 m . . . . . 0 CA--C 1.544 0.736 0 CA-C-O 120.585 0.231 . . . . 0.0 111.544 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.87 133.67 36.05 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.642 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -62.94 163.56 9.5 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.068 0.461 . . . . 0.0 112.141 -178.565 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.642 ' O ' ' HG2' ' A' ' 3' ' ' LYS . 4.8 mp -91.78 -172.49 3.22 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 176.701 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -87.37 147.44 25.47 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -177.576 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.531 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 65.0 m -113.45 164.36 15.97 Favored Pre-proline 0 C--N 1.301 -1.508 0 CA-C-N 113.759 -1.564 . . . . 0.0 110.591 -177.1 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.29 164.06 18.59 Favored 'Trans proline' 0 C--N 1.367 1.501 0 C-N-CA 122.2 1.934 . . . . 0.0 112.377 175.469 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -53.98 -35.66 62.06 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -174.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.55 4.76 50.31 Favored 'General case' 0 C--N 1.317 -0.809 0 O-C-N 121.986 -0.446 . . . . 0.0 111.418 -175.049 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 24.9 m95 -112.89 145.93 39.85 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 120.821 0.343 . . . . 0.0 110.973 -174.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.432 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.1 mm? -100.62 178.83 4.6 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 105.271 -2.122 . . . . 0.0 105.271 173.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.531 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 56.1 p -155.89 148.81 24.25 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 119.525 1.057 . . . . 0.0 113.334 179.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 29.2 t-80 -154.37 135.96 14.32 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 67.83 -70.87 0.11 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.625 1.17 . . . . 0.0 113.828 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.457 ' C ' ' HD3' ' A' ' 16' ' ' LYS . 9.4 p-10 -167.31 24.69 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.839 -174.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.457 ' HD3' ' C ' ' A' ' 15' ' ' ASP . 3.9 mppt? -144.5 143.8 31.03 Favored 'General case' 0 CA--C 1.511 -0.547 0 C-N-CA 122.834 0.454 . . . . 0.0 110.358 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.559 ' O ' ' HA ' ' A' ' 123' ' ' GLN . 15.2 m -97.1 151.36 19.84 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 174.306 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -130.77 134.04 46.52 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 118.486 0.585 . . . . 0.0 110.046 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -119.76 108.94 15.02 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.6 t -83.87 93.79 3.29 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.764 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.5 m -77.67 110.8 12.81 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.243 -177.538 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -83.44 14.35 3.75 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.889 0.876 . . . . 0.0 112.962 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.54 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 6.7 m -107.14 153.55 8.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.7 m -108.83 143.96 37.32 Favored 'General case' 0 C--N 1.3 -1.543 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -173.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -154.3 172.98 16.8 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 126.476 1.91 . . . . 0.0 108.994 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.4 p -77.86 166.68 22.61 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 171.224 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 t90 -56.56 -50.96 70.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.337 0.589 . . . . 0.0 111.477 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.439 ' H ' ' CD ' ' A' ' 28' ' ' GLU . 0.1 OUTLIER -65.92 -35.95 82.04 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.993 -176.615 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -66.3 -45.06 81.69 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.832 -179.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.65 -32.24 82.76 Favored Glycine 0 N--CA 1.465 0.594 0 C-N-CA 121.39 -0.434 . . . . 0.0 112.388 176.415 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tt -61.28 -51.52 68.56 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 58.8 t -61.92 -32.08 53.1 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.331 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.538 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 0.9 OUTLIER -61.65 -45.3 94.64 Favored 'General case' 0 CA--C 1.501 -0.935 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.853 174.835 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 60.5 m -64.25 -41.92 96.74 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -56.69 -38.05 71.74 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 123.793 0.683 . . . . 0.0 109.637 176.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.26 -23.15 61.8 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 114.913 -1.039 . . . . 0.0 114.036 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.538 ' HD2' ' O ' ' A' ' 33' ' ' ASP . 2.1 mptp? -97.27 2.73 51.14 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 117.915 0.857 . . . . 0.0 110.711 177.284 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.93 50.01 25.68 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 108.499 -1.84 . . . . 0.0 108.499 -173.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 123' ' ' GLN . . . -147.82 176.77 9.87 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.6 p -116.14 164.86 13.86 Favored 'General case' 0 C--N 1.292 -1.917 0 C-N-CA 122.798 0.439 . . . . 0.0 110.684 179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.0 tp -80.96 127.95 33.14 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 105.936 -1.876 . . . . 0.0 105.936 174.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.3 tpt -28.73 122.4 0.12 Allowed 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 -169.562 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -114.68 108.86 17.36 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.345 1.458 . . . . 0.0 107.387 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 52.9 mt -88.88 110.57 21.54 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.152 0.501 . . . . 0.0 111.512 -173.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -79.97 -32.32 39.85 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.794 -177.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -158.59 169.33 24.66 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -34.34 76.54 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 123.496 0.718 . . . . 0.0 109.62 178.507 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.487 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 12.0 pt-20 -58.38 -27.31 64.12 Favored 'General case' 0 C--O 1.243 0.723 0 C-N-CA 122.886 0.474 . . . . 0.0 111.363 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -66.92 -54.35 22.95 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.5 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 37.7 mt -66.65 -26.95 67.3 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 20.3 ptt180 -68.58 -32.02 71.64 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 119.331 -0.948 . . . . 0.0 109.363 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -74.26 -27.99 61.0 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.678 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -65.17 -48.15 74.48 Favored 'General case' 0 C--O 1.193 -1.906 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.5 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 46.3 mt -57.78 -33.43 68.52 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 123.412 0.445 . . . . 0.0 111.464 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.92 -41.76 97.57 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.551 175.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.3 p -88.27 -24.64 23.15 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -176.045 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.678 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.8 mm -56.33 -47.77 80.76 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 C-N-CA 123.603 0.761 . . . . 0.0 111.081 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 52.5 tptt 67.98 -69.65 0.14 Allowed 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.916 1.286 . . . . 0.0 113.696 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -65.55 -34.56 78.53 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.466 ' H ' HG23 ' A' ' 57' ' ' ILE . 49.4 mttp 72.98 -57.19 0.64 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.755 1.222 . . . . 0.0 112.354 177.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -68.74 6.55 0.83 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.168 1.387 . . . . 0.0 114.407 -170.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.579 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 51.2 m-80 -82.63 -168.49 2.04 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 173.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.446 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 8.3 m -140.22 114.51 9.19 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.134 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.579 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 4.9 m-85 -121.55 120.11 33.9 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.267 -177.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.412 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 55.0 m95 -62.81 137.59 58.31 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 123.067 0.547 . . . . 0.0 111.071 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.88 177.33 2.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 167.636 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.688 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.28 54.07 3.55 Favored Glycine 0 C--O 1.199 -2.07 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.382 -176.511 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 35.1 mt -126.52 118.28 24.58 Favored 'General case' 0 CA--C 1.489 -1.383 0 C-N-CA 123.55 0.74 . . . . 0.0 111.689 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -133.73 141.49 47.55 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 173.242 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.451 ' HE1' ' O ' ' A' ' 94' ' ' GLY . 59.1 t80 -86.14 112.59 21.45 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 104.26 -2.496 . . . . 0.0 104.26 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.472 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 1.2 p -85.68 119.75 26.37 Favored 'General case' 0 C--N 1.274 -2.681 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -173.574 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 70.4 mt -120.55 133.2 24.01 Favored Pre-proline 0 N--CA 1.432 -1.348 0 C-N-CA 120.409 -0.516 . . . . 0.0 110.869 174.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -85.73 135.97 20.18 Favored 'Cis proline' 0 CA--C 1.55 1.288 0 C-N-CA 122.791 -1.754 . . . . 0.0 111.287 -2.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.472 ' HB3' ' O ' ' A' ' 71' ' ' THR . 14.4 t70 173.37 -39.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 -175.441 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 2.1 mpt? 63.94 19.44 11.75 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.756 2.023 . . . . 0.0 115.381 174.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -120.56 162.31 19.84 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 122.145 -0.347 . . . . 0.0 110.112 176.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -95.27 111.46 23.31 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.313 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -114.38 147.65 38.86 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.102 -178.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.688 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 49.0 m95 -93.4 169.21 10.54 Favored 'General case' 0 N--CA 1.429 -1.522 0 CA-C-N 114.772 -1.103 . . . . 0.0 108.55 178.282 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 40.8 pt -71.83 -13.9 17.11 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.909 -178.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.576 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 33.7 p-10 -89.84 -11.0 43.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.485 0.659 . . . . 0.0 109.402 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.12 1.05 44.84 Favored Glycine 0 CA--C 1.499 -0.918 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.155 174.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 57.2 m -80.04 165.77 22.21 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 122.834 0.454 . . . . 0.0 111.939 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.3 m -105.05 141.87 35.85 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.322 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 39.0 tp -56.91 140.21 49.21 Favored 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 124.98 1.312 . . . . 0.0 113.845 178.132 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -95.2 98.39 10.59 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 166.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.4 p -70.61 -8.68 53.48 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -175.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -78.44 -6.0 54.06 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 27.5 m -74.73 -48.22 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 C-N-CA 119.045 -1.062 . . . . 0.0 111.266 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.1 mt -153.78 177.56 10.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -177.717 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.89 109.51 2.11 Favored 'General case' 0 CA--C 1.499 -1.001 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 9.4 mt -146.66 106.3 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 171.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.7 m -63.97 122.26 16.07 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.451 ' O ' ' HE1' ' A' ' 70' ' ' TYR . . . -89.54 -19.53 48.43 Favored Glycine 0 N--CA 1.419 -2.445 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -174.442 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -122.3 104.84 9.7 Favored 'General case' 0 N--CA 1.422 -1.825 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 175.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . 0.421 HG22 ' H ' ' A' ' 98' ' ' ASN . 12.3 t -141.36 -26.05 0.7 Allowed 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.4 -173.578 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 62.67 29.41 16.85 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.421 ' H ' HG22 ' A' ' 96' ' ' THR . 40.6 m-80 -122.53 143.84 49.47 Favored 'General case' 0 C--O 1.205 -1.282 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 175.683 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -82.55 27.32 0.52 Allowed 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 125.049 1.34 . . . . 0.0 110.622 -172.177 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.431 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 32.8 t -74.09 158.29 34.51 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 125.782 1.633 . . . . 0.0 112.276 -173.572 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 88.5 m -117.31 143.88 45.46 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -89.45 143.12 27.07 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-O 121.427 0.632 . . . . 0.0 112.154 -175.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -141.07 151.74 44.26 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.556 -178.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.446 ' O ' ' HA ' ' A' ' 63' ' ' SER . 13.9 mm -77.48 121.77 30.74 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 175.243 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 8.8 t -145.32 97.31 2.98 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.71 -119.83 6.66 Favored Glycine 0 C--N 1.283 -2.374 0 CA-C-N 114.317 -1.31 . . . . 0.0 110.186 179.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.51 ' OD2' ' HE2' ' A' ' 108' ' ' LYS . 6.5 p-10 -115.19 8.52 15.59 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 123.323 0.649 . . . . 0.0 109.249 177.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.51 ' HE2' ' OD2' ' A' ' 107' ' ' ASP . 74.4 mmtt -134.92 174.69 10.32 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.486 -176.266 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.3 t -101.39 130.65 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.031 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 175.83 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 59.1 p -131.6 141.83 49.75 Favored 'General case' 0 C--N 1.272 -2.788 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.431 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 6.8 p90 -99.79 133.1 44.64 Favored 'General case' 0 C--N 1.287 -2.115 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -177.78 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -121.1 165.75 14.89 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 114.427 -1.261 . . . . 0.0 107.622 -174.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 38.2 m -64.74 130.59 44.11 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 8.5 m -59.98 -19.64 53.35 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.417 0.627 . . . . 0.0 111.434 -175.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -93.38 4.39 54.04 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.255 1.022 . . . . 0.0 112.574 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.4 p -73.54 -7.95 53.96 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 13.8 t70 62.64 87.48 0.1 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.628 1.171 . . . . 0.0 110.392 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -127.81 175.07 8.61 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -177.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.764 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.2 mpt_? -83.43 -174.7 5.44 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 -177.739 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.441 ' CH2' HG23 ' A' ' 23' ' ' VAL . 26.9 p90 -156.58 172.72 18.08 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.659 1.118 . . . . 0.0 112.132 -177.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 85.5 mt -126.44 122.59 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-O 121.417 0.627 . . . . 0.0 110.128 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 74.3 m -100.12 143.72 29.99 Favored 'General case' 0 C--N 1.29 -2.022 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.56 ' O ' ' HB3' ' A' ' 39' ' ' ALA . 6.3 pt20 -121.54 154.06 37.18 Favored 'General case' 0 N--CA 1.417 -2.089 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 173.698 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.6 ttmm -132.33 110.47 10.6 Favored 'General case' 0 C--N 1.268 -2.95 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 176.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.433 ' HG3' ' ND1' ' A' ' 128' ' ' HIS . 0.8 OUTLIER -75.9 118.33 18.58 Favored 'General case' 0 C--N 1.282 -2.338 0 CA-C-O 121.648 0.737 . . . . 0.0 111.96 -177.304 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.448 ' HB3' ' CD1' ' A' ' 4' ' ' LEU . 2.6 mm? -69.12 -40.17 78.48 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.414 176.766 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -156.11 95.8 1.64 Allowed 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.703 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . 0.433 ' ND1' ' HG3' ' A' ' 125' ' ' GLU . 1.3 p-80 -79.28 151.81 30.9 Favored 'General case' 0 C--O 1.25 1.086 0 C-N-CA 118.973 -1.091 . . . . 0.0 108.809 173.087 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 71.65 -172.82 0.16 Allowed 'General case' 0 N--CA 1.469 0.49 0 O-C-N 124.3 1.0 . . . . 0.0 109.657 -175.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 59.5 m -140.0 129.52 24.22 Favored 'General case' 0 C--N 1.288 -2.099 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 176.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -73.75 -42.75 60.68 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.478 -170.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 13.9 t -96.26 140.08 31.46 Favored 'General case' 0 N--CA 1.42 -1.933 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -115.28 -92.22 0.51 Allowed 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.879 -0.729 . . . . 0.0 111.89 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -147.99 132.38 17.58 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 -174.217 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.82 -8.44 9.53 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 175.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 97.22 -109.77 3.9 Favored Glycine 0 N--CA 1.43 -1.746 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -112.38 7.29 19.13 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 175.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 77.63 79.73 0.71 Allowed Glycine 0 N--CA 1.427 -1.951 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 -176.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 37.3 t60 . . . . . 0 C--N 1.304 -1.391 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -176.302 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . 0.519 ' H2 ' ' CG ' ' A' ' 15' ' ' ASP . 15.2 m . . . . . 0 N--CA 1.437 -1.123 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -157.22 -38.71 0.07 Allowed 'General case' 0 CA--C 1.5 -0.966 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.165 -175.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.496 ' HB3' ' NZ ' ' A' ' 3' ' ' LYS . 3.5 ttpm? 71.06 113.69 0.05 Allowed 'General case' 0 N--CA 1.444 -0.745 0 O-C-N 124.327 1.017 . . . . 0.0 111.66 -174.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.434 ' N ' HD13 ' A' ' 4' ' ' LEU . 2.2 mp -85.61 -163.09 0.8 Allowed 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 178.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -99.21 140.14 33.82 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.168 -1.013 . . . . 0.0 111.8 178.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.505 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 65.7 m -101.93 161.91 22.0 Favored Pre-proline 0 C--N 1.309 -1.179 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.665 -176.03 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.599 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 31.8 Cg_exo -61.81 156.37 48.93 Favored 'Trans proline' 0 CA--C 1.555 1.562 0 C-N-CA 121.612 1.541 . . . . 0.0 109.854 173.608 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -51.71 -33.66 35.34 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 116.528 2.048 . . . . 0.0 116.528 -169.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -97.71 5.77 48.83 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 121.714 -0.616 . . . . 0.0 111.887 -174.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.599 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 17.3 m95 -101.14 135.95 41.78 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 120.647 0.261 . . . . 0.0 111.302 -174.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.4 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.5 mm? -93.83 130.4 39.88 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.505 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 25.8 p -96.43 130.25 43.61 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -175.67 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -151.09 119.44 6.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.954 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.8 mtm180 54.68 46.36 24.85 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 125.849 1.659 . . . . 0.0 112.796 175.315 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.545 ' OD1' ' HE1' ' A' ' 127' ' ' TYR . 14.5 m-20 69.73 36.27 2.15 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.136 0.974 . . . . 0.0 111.026 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.434 ' O ' ' HA ' ' A' ' 12' ' ' SER . 10.2 mptt -141.72 159.83 41.42 Favored 'General case' 0 CA--C 1.499 -1.001 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 174.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.686 ' SG ' HD12 ' A' ' 126' ' ' LEU . 4.6 m -129.44 132.26 46.93 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 177.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 19.3 m-85 -111.41 137.28 49.4 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 117.911 0.323 . . . . 0.0 110.832 -177.157 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.463 ' HB2' ' CE2' ' A' ' 10' ' ' TRP . 42.3 t-80 -121.11 108.33 13.67 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.7 t -88.22 93.59 4.31 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 176.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.716 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 4.1 m -77.76 113.56 15.75 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.053 -177.079 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.463 ' C ' ' HG2' ' A' ' 119' ' ' ARG . 13.4 mm100 -85.0 14.36 5.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.803 0.841 . . . . 0.0 111.962 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.438 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 13.9 m -105.68 157.21 6.38 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 179.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 m -110.4 147.29 34.3 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -169.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.404 ' HB3' ' HB3' ' A' ' 29' ' ' GLU . 35.2 m-20 -159.73 -178.07 6.81 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 126.491 1.916 . . . . 0.0 108.7 -178.555 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 71.2 p -86.5 170.38 11.98 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 171.454 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 87.9 t90 -59.91 -51.58 69.09 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.016 0.436 . . . . 0.0 110.43 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.482 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 49.9 mt-10 -67.47 -31.23 71.24 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.726 -177.291 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . 0.404 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 7.8 tp10 -67.21 -49.55 64.13 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.689 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.88 -31.92 80.1 Favored Glycine 0 C--N 1.344 0.975 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.782 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.482 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 3.1 tm? -55.2 -51.29 67.03 Favored 'General case' 0 C--O 1.251 1.158 0 C-N-CA 124.17 0.988 . . . . 0.0 109.04 176.058 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 57.5 t -67.06 -35.09 73.64 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.468 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.43 -36.55 76.1 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 176.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 61.8 m -70.61 -41.86 71.72 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.417 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -61.74 -25.66 67.58 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.88 -37.16 93.89 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.761 -0.654 . . . . 0.0 113.199 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -86.46 2.73 46.77 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.858 -0.201 . . . . 0.0 110.779 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.52 41.38 30.02 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 108.665 -1.774 . . . . 0.0 108.665 -174.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -132.83 177.07 7.92 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.783 -0.708 . . . . 0.0 109.227 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.43 ' HB ' HD12 ' A' ' 80' ' ' ILE . 2.7 p -120.9 154.04 36.41 Favored 'General case' 0 C--N 1.279 -2.479 0 O-C-N 123.634 0.584 . . . . 0.0 109.498 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.6 tp -66.05 139.81 58.22 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 172.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.9 tpt -35.82 118.75 0.52 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 114.681 1.364 . . . . 0.0 114.681 -170.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.0 tp -120.51 106.35 11.72 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 -174.525 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.44 ' HB ' ' CH2' ' A' ' 79' ' ' TRP . 30.7 mt -98.05 112.96 31.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 CA-C-O 121.25 0.548 . . . . 0.0 111.949 -169.04 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -90.16 -31.22 17.16 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.67 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -143.65 161.54 38.27 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -173.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.496 ' NE2' ' HA ' ' A' ' 89' ' ' VAL . 6.9 tt0 -74.32 -25.36 59.51 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 122.536 0.334 . . . . 0.0 110.565 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.649 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 7.7 pt-20 -69.08 -26.13 64.79 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.935 176.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -57.27 -54.1 50.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 173.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.473 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 62.4 mt -67.69 -26.8 66.36 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.649 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 4.1 ppt_? -66.45 -36.6 83.18 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -73.44 -25.74 60.64 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.67 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -63.53 -48.82 75.96 Favored 'General case' 0 CA--C 1.477 -1.848 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 172.941 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.473 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 37.7 mt -55.12 -38.8 68.65 Favored 'General case' 0 C--O 1.244 0.784 0 O-C-N 123.756 0.66 . . . . 0.0 110.717 177.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -59.16 -43.19 92.1 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.73 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.8 p -81.26 -27.01 35.34 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.67 HG12 ' O ' ' A' ' 53' ' ' LEU . 32.7 mm -67.1 -58.21 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.562 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -178.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? 67.36 -59.07 0.41 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.84 0.856 . . . . 0.0 112.921 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -61.04 -60.36 3.9 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 123.079 0.552 . . . . 0.0 112.418 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt 71.16 15.51 6.47 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.9 0.88 . . . . 0.0 113.044 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 67.0 m-85 -125.59 30.84 5.66 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.631 0.729 . . . . 0.0 111.62 -179.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.459 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 65.2 m-80 -127.11 -159.66 0.95 Allowed 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 175.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.616 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 54.7 m -151.97 126.68 9.54 Favored 'General case' 0 C--O 1.25 1.107 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 173.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.532 ' CE2' HD12 ' A' ' 57' ' ' ILE . 1.1 m-85 -128.83 118.78 23.32 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -176.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 70.3 m95 -59.38 140.14 56.39 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 123.804 0.842 . . . . 0.0 112.018 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -119.53 174.48 4.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 169.333 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.636 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.84 58.54 3.48 Favored Glycine 0 C--O 1.205 -1.703 0 CA-C-N 119.294 0.952 . . . . 0.0 113.76 -175.006 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.9 mt -127.44 113.86 16.74 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 123.743 0.817 . . . . 0.0 111.282 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -122.42 137.65 54.8 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.553 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -93.52 113.06 25.09 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.472 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 9.3 p -102.72 126.49 49.84 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.413 -174.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.427 HD13 ' HA ' ' A' ' 97' ' ' GLU . 57.7 mt -120.69 144.88 39.76 Favored Pre-proline 0 C--N 1.31 -1.125 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 174.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -83.27 128.15 13.36 Favored 'Cis proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.366 -1.514 . . . . 0.0 111.574 -1.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.472 ' HB3' ' O ' ' A' ' 71' ' ' THR . 27.7 t70 179.94 -46.45 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.502 0.721 . . . . 0.0 109.505 -177.008 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 86.2 mtp 70.54 17.58 6.72 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 175.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -120.64 145.14 47.71 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 120.589 -0.445 . . . . 0.0 110.359 175.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -87.88 125.4 34.46 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 176.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -124.0 155.3 38.49 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 119.689 -0.804 . . . . 0.0 111.125 175.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.636 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 19.3 m95 -90.53 176.01 6.85 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 114.548 -1.205 . . . . 0.0 108.522 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.43 HD12 ' HB ' ' A' ' 40' ' ' THR . 49.8 pt -72.71 -15.48 17.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -177.639 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.481 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 30.5 p-10 -88.11 -7.97 56.14 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.73 8.08 62.44 Favored Glycine 0 N--CA 1.444 -0.816 0 CA-C-N 114.771 -1.104 . . . . 0.0 113.766 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.4 t -81.09 167.82 19.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.323 0.562 . . . . 0.0 109.613 -179.082 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.1 m -90.46 139.68 30.45 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 35.0 tp -55.18 138.99 43.48 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.015 173.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.463 ' OD1' HG11 ' A' ' 89' ' ' VAL . 26.4 t-20 -98.29 91.46 5.24 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 170.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 39.5 p -71.88 -4.92 30.89 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.3 0.572 . . . . 0.0 111.849 -177.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -75.43 -18.13 59.99 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.555 -178.098 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.496 ' HA ' ' NE2' ' A' ' 47' ' ' GLN . 33.6 m -75.41 -55.47 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.511 0 C-N-CA 119.111 -1.036 . . . . 0.0 112.494 -177.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 87.0 mt -145.51 -177.8 5.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.014 0.435 . . . . 0.0 111.344 -172.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.555 ' O ' ' HB ' ' A' ' 109' ' ' VAL . 10.7 tptm -57.72 98.69 0.03 OUTLIER 'General case' 0 C--O 1.208 -1.093 0 C-N-CA 125.866 1.666 . . . . 0.0 112.182 176.725 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.441 HG12 ' HB ' ' A' ' 109' ' ' VAL . 4.8 mt -150.69 111.02 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.911 0 N-CA-C 106.822 -1.548 . . . . 0.0 106.822 171.48 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.1 m -71.45 133.7 46.07 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 177.509 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.81 -53.99 3.2 Favored Glycine 0 CA--C 1.47 -2.753 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -173.584 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -96.87 132.02 43.03 Favored 'General case' 0 N--CA 1.421 -1.894 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.9 t -152.25 -19.92 0.17 Allowed 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.804 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.427 ' HA ' HD13 ' A' ' 72' ' ' LEU . 5.8 mm-40 60.88 36.14 19.04 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 123.964 0.906 . . . . 0.0 113.377 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -117.47 171.73 7.8 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.693 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -93.85 28.32 2.43 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 125.762 1.625 . . . . 0.0 108.021 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 66.8 m -84.11 155.73 22.49 Favored 'General case' 0 N--CA 1.422 -1.854 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -169.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 84.0 m -131.63 149.33 52.53 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 105.858 -1.904 . . . . 0.0 105.858 171.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -91.09 146.45 23.83 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -173.166 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.48 144.84 32.16 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.588 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.616 ' O ' ' HA ' ' A' ' 63' ' ' SER . 7.7 mm -77.33 124.74 36.29 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 177.033 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.438 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 23.3 t -94.07 -43.21 8.61 Favored 'General case' 0 N--CA 1.414 -2.233 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 173.73 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.52 -109.36 0.22 Allowed Glycine 0 N--CA 1.418 -2.563 0 N-CA-C 109.12 -1.592 . . . . 0.0 109.12 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -75.81 -19.16 59.16 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -110.89 154.47 24.0 Favored 'General case' 0 C--O 1.259 1.589 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.201 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . 0.555 ' HB ' ' O ' ' A' ' 91' ' ' LYS . 23.6 t -106.0 130.03 58.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 175.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.0 p -130.94 151.65 51.13 Favored 'General case' 0 C--N 1.27 -2.887 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -174.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 19.7 p90 -126.83 133.11 50.83 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 -173.749 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -129.46 174.51 9.57 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . 0.448 ' HB3' ' ND2' ' A' ' 115' ' ' ASN . 19.7 m -53.94 129.96 35.84 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.76 0.662 . . . . 0.0 109.224 174.355 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.2 m -58.87 -20.55 52.18 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.864 0.866 . . . . 0.0 112.33 -174.478 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . 0.448 ' ND2' ' HB3' ' A' ' 113' ' ' SER . 9.7 p30 -80.6 -9.08 59.8 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.291 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 51.0 p -68.02 144.8 54.98 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 120.346 -0.541 . . . . 0.0 110.753 -177.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -80.84 89.32 5.83 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.504 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . 0.532 ' OD1' ' HB2' ' A' ' 63' ' ' SER . 35.1 m-80 -125.92 170.48 11.63 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.449 -178.123 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.716 ' HB3' ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -89.82 179.6 5.95 Favored 'General case' 0 C--N 1.287 -2.117 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 -178.304 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.4 ' CZ3' HG22 ' A' ' 23' ' ' VAL . 17.9 p90 -153.24 165.01 37.06 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.757 1.162 . . . . 0.0 112.201 -175.236 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 80.8 mt -120.18 127.31 75.89 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.973 179.144 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 70.9 m -106.89 142.58 36.29 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.44 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.3 pt20 -124.18 135.93 53.82 Favored 'General case' 0 N--CA 1.417 -2.093 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 171.816 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -108.94 109.25 20.28 Favored 'General case' 0 C--N 1.254 -3.554 0 N-CA-C 105.411 -2.07 . . . . 0.0 105.411 174.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.468 ' O ' ' HB2' ' A' ' 128' ' ' HIS . 36.9 tt0 -68.62 124.4 23.5 Favored 'General case' 0 N--CA 1.414 -2.241 0 N-CA-C 104.499 -2.408 . . . . 0.0 104.499 174.082 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.686 HD12 ' SG ' ' A' ' 17' ' ' CYS . 6.8 tp -66.44 -22.39 66.22 Favored 'General case' 0 C--N 1.284 -2.261 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.598 -166.428 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' TYR . . . . . 0.545 ' HE1' ' OD1' ' A' ' 15' ' ' ASP . 50.9 m-85 -101.27 92.2 4.85 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 168.708 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . 0.468 ' HB2' ' O ' ' A' ' 125' ' ' GLU . 26.2 t-80 -128.53 19.15 6.27 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 122.383 1.087 . . . . 0.0 108.837 -175.076 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -77.78 76.77 4.3 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.119 -176.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 8.1 m -88.84 -14.25 37.38 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 172.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 85.1 mt -133.36 141.1 47.75 Favored 'General case' 0 N--CA 1.427 -1.601 0 N-CA-C 105.069 -2.197 . . . . 0.0 105.069 176.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 32.0 t -84.35 -73.37 0.43 Allowed 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 177.428 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -123.63 -52.68 1.8 Allowed 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -149.88 160.76 43.32 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.347 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 74.6 t -83.12 -38.56 14.67 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-O 121.401 0.619 . . . . 0.0 110.978 178.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 91.2 -62.97 2.8 Favored Glycine 0 C--O 1.22 -0.724 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -176.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -84.2 15.36 3.57 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 122.141 0.972 . . . . 0.0 110.638 175.186 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -129.29 11.0 6.14 Favored Glycine 0 N--CA 1.428 -1.852 0 N-CA-C 108.391 -1.884 . . . . 0.0 108.391 173.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 83.1 t60 . . . . . 0 C--O 1.244 0.8 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 -178.347 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.7 m . . . . . 0 N--CA 1.446 -0.661 0 CA-C-O 120.683 0.278 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.71 -179.83 3.98 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 175.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.528 ' HB2' ' O ' ' A' ' 14' ' ' ARG . 13.5 tppt? -123.57 -59.67 1.52 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 122.011 0.91 . . . . 0.0 109.159 -177.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.471 ' HB2' ' HB3' ' A' ' 126' ' ' LEU . 5.0 mp -121.62 -176.86 3.41 Favored 'General case' 0 C--N 1.261 -3.239 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 171.531 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -95.34 141.17 29.22 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.583 0.706 . . . . 0.0 111.343 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . 0.413 ' HB3' HD13 ' A' ' 126' ' ' LEU . 14.6 p -125.95 170.76 8.9 Favored Pre-proline 0 C--N 1.29 -2.006 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.026 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.636 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 52.3 Cg_exo -58.42 152.77 51.99 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 122.855 2.37 . . . . 0.0 112.487 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -58.55 -31.63 68.14 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 -171.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -89.92 8.68 31.03 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.405 0.622 . . . . 0.0 110.641 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.636 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 31.8 m95 -111.4 131.23 55.35 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.913 -176.51 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.446 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.7 mm? -85.2 117.71 24.31 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . 0.638 ' HA ' ' SG ' ' A' ' 17' ' ' CYS . 1.8 m -78.95 123.59 27.42 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.96 -175.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 27.7 t-80 -145.29 114.11 6.86 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 122.019 -0.425 . . . . 0.0 110.044 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.528 ' O ' ' HB2' ' A' ' 3' ' ' LYS . 56.6 mtp180 71.02 -85.17 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.31 1.044 . . . . 0.0 111.88 176.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -146.42 19.2 1.36 Allowed 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 123.816 0.847 . . . . 0.0 109.98 -176.384 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.498 ' HG2' ' NE2' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -143.56 160.33 40.82 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 175.961 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.638 ' SG ' ' HA ' ' A' ' 12' ' ' SER . 79.3 m -125.99 142.3 51.58 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 173.543 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -110.8 144.04 40.41 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.738 0.304 . . . . 0.0 111.684 -171.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -123.25 109.07 13.5 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 176.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.7 t -83.92 91.94 2.86 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.179 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.721 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 6.5 m -78.33 105.84 9.85 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.493 HE22 ' ND2' ' A' ' 62' ' ' ASN . 12.3 mm100 -77.49 14.43 1.0 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.47 1.108 . . . . 0.0 112.65 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.483 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.0 m -108.62 157.92 8.66 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.932 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.4 m -106.84 156.77 18.33 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -171.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 33.4 m-20 -167.81 175.29 6.96 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 128.024 2.53 . . . . 0.0 107.948 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.1 p -82.01 176.61 9.4 Favored 'General case' 0 C--O 1.257 1.471 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 171.348 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -61.81 -50.86 70.62 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.276 49.1 mt-10 -67.68 -30.62 70.19 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.81 -49.26 68.89 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.818 -0.753 . . . . 0.0 110.965 172.756 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.85 -33.9 86.93 Favored Glycine 0 C--N 1.339 0.741 0 N-CA-C 111.522 -0.631 . . . . 0.0 111.522 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.33 -52.87 62.07 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.848 0.859 . . . . 0.0 108.992 176.173 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.48 -31.8 52.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.198 0.523 . . . . 0.0 111.019 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.419 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 1.0 OUTLIER -62.46 -36.38 82.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.487 176.625 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.3 m -68.1 -41.09 82.32 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 175.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -57.36 -35.92 70.56 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.413 0.625 . . . . 0.0 109.622 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -63.08 -14.54 53.63 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 115.013 -0.994 . . . . 0.0 114.061 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . 0.419 ' HD2' ' O ' ' A' ' 33' ' ' ASP . 3.3 mptp? -108.36 3.54 23.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 117.622 0.711 . . . . 0.0 110.644 176.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.87 28.79 66.2 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -174.63 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -118.51 176.84 5.06 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 124.261 1.024 . . . . 0.0 108.705 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -123.52 149.69 44.9 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.56 125.57 25.61 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 177.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.4 tpt -26.62 121.98 0.08 Allowed 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 116.732 2.123 . . . . 0.0 116.732 -169.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -112.16 105.27 13.57 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.927 1.291 . . . . 0.0 107.599 178.213 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.418 HD13 HD13 ' A' ' 50' ' ' LEU . 56.5 mt -85.3 117.94 31.29 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.134 -175.677 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -82.5 -54.49 5.15 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.265 0.555 . . . . 0.0 111.404 179.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.518 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 17.1 m-20 -137.04 -179.02 5.46 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 122.119 -0.363 . . . . 0.0 111.072 -171.086 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -39.63 80.72 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 -178.365 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -58.71 -28.26 65.65 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.792 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.518 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 6.5 mm-40 -60.21 -55.18 36.9 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 175.479 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.632 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 46.3 mt -68.85 -26.09 64.97 Favored 'General case' 0 C--O 1.202 -1.424 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -177.487 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -64.25 -38.32 90.63 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.308 -0.557 . . . . 0.0 109.694 174.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -73.1 -28.5 62.32 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.614 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -66.22 -51.89 53.2 Favored 'General case' 0 C--O 1.183 -2.425 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 174.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.632 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 50.9 mt -54.8 -33.36 61.39 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -72.89 -46.21 53.98 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.543 174.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.3 p -75.53 -27.04 58.54 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.127 0.489 . . . . 0.0 111.831 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.614 HG12 ' O ' ' A' ' 53' ' ' LEU . 34.2 mm -58.7 -48.92 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.243 174.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? 67.99 -66.41 0.22 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.037 0.935 . . . . 0.0 112.667 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -62.01 -51.28 68.67 Favored 'General case' 0 C--O 1.207 -1.142 0 C-N-CA 123.842 0.857 . . . . 0.0 111.131 -176.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.448 ' H ' HG23 ' A' ' 57' ' ' ILE . 3.8 ttmp? 71.31 -40.85 0.49 Allowed 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -80.81 37.68 0.43 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.787 0.803 . . . . 0.0 112.911 -174.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.569 ' O ' ' HA ' ' A' ' 105' ' ' SER . 54.2 m-80 -124.97 -158.88 0.85 Allowed 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 176.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.47 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 15.3 m -143.28 117.82 9.75 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.513 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 2.2 m-85 -122.56 117.5 26.03 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -63.15 139.77 58.81 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 123.063 0.545 . . . . 0.0 111.428 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -117.76 172.76 5.09 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 168.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.58 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -74.92 44.09 1.5 Allowed Glycine 0 C--O 1.216 -1.01 0 CA-C-N 119.132 0.878 . . . . 0.0 114.544 -174.054 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.507 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 28.8 mt -114.37 123.68 50.07 Favored 'General case' 0 CA--C 1.483 -1.614 0 C-N-CA 123.793 0.837 . . . . 0.0 111.898 -178.358 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -142.52 140.69 31.91 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 120.086 -0.645 . . . . 0.0 110.076 171.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.558 ' HD2' ' O ' ' A' ' 98' ' ' ASN . 82.9 t80 -83.02 113.21 20.43 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 32.5 p -102.38 132.93 48.06 Favored 'General case' 0 C--N 1.283 -2.284 0 C-N-CA 119.856 -0.738 . . . . 0.0 112.325 -173.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.6 mt -120.58 140.17 30.01 Favored Pre-proline 0 N--CA 1.428 -1.526 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.899 174.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -86.81 132.76 14.06 Favored 'Cis proline' 0 N--CA 1.452 -0.932 0 C-N-CA 123.298 -1.542 . . . . 0.0 110.757 -3.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.438 ' HB3' ' O ' ' A' ' 71' ' ' THR . 11.6 t70 178.46 -42.8 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 -174.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 4.4 mpp? 65.27 17.28 10.94 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 113.619 -1.628 . . . . 0.0 114.258 176.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -122.47 158.22 30.26 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.26 0.552 . . . . 0.0 110.789 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.441 ' HE1' ' HA2' ' A' ' 94' ' ' GLY . 83.0 m95 -88.92 112.71 23.63 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 173.513 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -116.86 154.64 30.41 Favored 'General case' 0 C--N 1.278 -2.504 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.922 -176.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.58 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 47.2 m95 -98.55 165.5 11.79 Favored 'General case' 0 N--CA 1.425 -1.722 0 CA-C-N 114.504 -1.225 . . . . 0.0 109.353 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.1 pt -73.28 -13.76 16.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.063 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.421 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 29.4 p-10 -92.61 -0.66 57.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.396 0.617 . . . . 0.0 109.844 -178.283 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.46 -2.72 57.59 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.016 -0.993 . . . . 0.0 114.256 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.1 t -84.82 170.6 13.01 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 117.609 0.705 . . . . 0.0 109.852 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.3 m -112.15 145.49 39.72 Favored 'General case' 0 N--CA 1.419 -2.004 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 43.0 tp -53.86 131.98 40.87 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -178.421 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -86.51 87.85 7.52 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 168.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.2 m -64.18 -10.88 25.82 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.923 -177.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -77.72 -6.56 54.41 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 22.6 m -74.32 -48.96 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 118.764 -1.174 . . . . 0.0 111.924 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.2 mt -156.72 -178.09 7.09 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 -175.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -73.49 123.31 23.67 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.0 mt -142.59 132.33 22.6 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 N-CA-C 105.721 -1.955 . . . . 0.0 105.721 171.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.2 m -112.71 131.94 55.43 Favored 'General case' 0 C--N 1.288 -2.083 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.192 -173.633 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . 0.441 ' HA2' ' HE1' ' A' ' 77' ' ' TRP . . . -91.87 -14.46 56.44 Favored Glycine 0 N--CA 1.426 -2.028 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -77.25 111.16 12.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 174.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.5 t -171.32 -42.86 0.02 OUTLIER 'General case' 0 C--N 1.274 -2.674 0 CA-C-N 114.473 -1.239 . . . . 0.0 108.43 -175.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 68.09 19.06 9.34 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.145 1.378 . . . . 0.0 111.373 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.558 ' O ' ' HD2' ' A' ' 70' ' ' TYR . 26.3 m-80 -121.71 152.9 38.9 Favored 'General case' 0 CA--C 1.498 -1.048 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -72.16 30.46 0.05 Allowed 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 126.346 1.858 . . . . 0.0 110.527 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.471 ' H ' ' C ' ' A' ' 98' ' ' ASN . 41.0 t -62.36 149.07 43.35 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 126.14 1.776 . . . . 0.0 112.802 -172.186 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 90.1 m -112.92 145.31 40.97 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.067 -0.969 . . . . 0.0 108.794 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -98.0 147.2 24.74 Favored 'General case' 0 C--O 1.255 1.364 0 CA-C-O 121.3 0.571 . . . . 0.0 111.898 -176.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -139.53 152.21 46.74 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.486 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.47 ' O ' ' HA ' ' A' ' 63' ' ' SER . 17.3 mm -77.85 112.53 15.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 N-CA-C 105.388 -2.079 . . . . 0.0 105.388 172.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' SER . . . . . 0.569 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 8.5 t -131.82 33.53 3.96 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-O 122.376 1.084 . . . . 0.0 108.511 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.66 -139.82 6.65 Favored Glycine 0 N--CA 1.412 -2.913 0 N-CA-C 108.277 -1.929 . . . . 0.0 108.277 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.425 ' OD2' ' HE3' ' A' ' 108' ' ' LYS . 14.2 p-10 -98.99 8.82 44.64 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.363 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . 0.425 ' HE3' ' OD2' ' A' ' 107' ' ' ASP . 32.4 mmtp -130.43 163.65 26.46 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.102 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.11 119.83 47.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 179.697 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.1 p -122.04 143.78 49.3 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 23.6 p90 -109.67 145.86 35.8 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -173.082 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -135.76 175.43 9.6 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.79 -1.096 . . . . 0.0 109.942 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.3 m -67.57 127.06 31.33 Favored 'General case' 0 N--CA 1.413 -2.305 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 171.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 20.5 m -56.33 -21.79 26.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.465 0.706 . . . . 0.0 112.585 -173.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -77.15 -3.46 39.59 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 30.6 p -75.97 140.39 42.02 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 119.316 0.962 . . . . 0.0 111.389 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.58 89.1 7.05 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.546 0.689 . . . . 0.0 109.444 -177.011 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -120.78 174.38 6.63 Favored 'General case' 0 C--O 1.196 -1.759 0 C-N-CA 124.563 1.145 . . . . 0.0 109.832 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.721 ' HB3' ' O ' ' A' ' 21' ' ' SER . 3.4 mpt_? -85.87 -178.77 6.67 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -176.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 24.8 p90 -153.18 162.77 40.93 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 118.688 -1.205 . . . . 0.0 111.999 -176.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 75.6 mt -120.13 125.57 74.37 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-O 121.237 0.542 . . . . 0.0 109.856 178.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 71.7 m -105.24 145.25 30.9 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 176.538 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.498 ' NE2' ' HG2' ' A' ' 16' ' ' LYS . 8.7 pt20 -122.61 133.5 54.54 Favored 'General case' 0 N--CA 1.412 -2.326 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 171.258 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -110.66 108.0 17.76 Favored 'General case' 0 N--CA 1.397 -3.124 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 173.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -68.74 134.43 49.77 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-N 113.989 -1.459 . . . . 0.0 108.365 -177.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 4' ' ' LEU . 1.7 mm? -67.37 -27.38 67.06 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.782 0.801 . . . . 0.0 109.404 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -89.1 21.9 3.0 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.853 177.373 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.67 -6.66 38.71 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -54.65 108.9 0.43 Allowed 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.577 -1.192 . . . . 0.0 107.988 175.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 6.7 m -89.18 154.87 19.8 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 -178.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.88 -35.25 80.02 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 18.0 m -124.14 96.35 4.89 Favored 'General case' 0 N--CA 1.422 -1.849 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 173.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -86.49 70.36 10.45 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -174.86 161.82 3.1 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 105.271 -2.122 . . . . 0.0 105.271 -174.438 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 57.6 t -71.59 -39.3 69.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 177.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 95.41 -11.12 69.05 Favored Glycine 0 CA--C 1.504 -0.651 0 N-CA-C 115.122 0.809 . . . . 0.0 115.122 168.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 60.42 17.55 7.32 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.702 0.801 . . . . 0.0 110.507 -178.241 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 137.38 -30.33 2.62 Favored Glycine 0 N--CA 1.43 -1.763 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.909 -176.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 . . . . . 0 C--N 1.308 -1.238 0 O-C-N 122.353 -0.498 . . . . 0.0 110.025 -179.719 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.7 m . . . . . 0 C--O 1.236 0.344 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 66.63 110.81 0.04 OUTLIER 'General case' 0 C--N 1.349 0.583 0 C-N-CA 124.091 0.957 . . . . 0.0 109.631 -175.155 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.441 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 2.2 tmpt? 71.62 131.45 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 122.417 1.103 . . . . 0.0 112.487 -173.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.497 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 5.0 mp -100.04 179.38 4.51 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 175.648 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -80.67 140.52 35.6 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.766 0.793 . . . . 0.0 112.583 -176.443 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.8 p -128.18 165.92 27.52 Favored Pre-proline 0 C--N 1.296 -1.759 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.517 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.684 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 52.4 Cg_exo -54.08 162.16 4.34 Favored 'Trans proline' 0 C--N 1.373 1.826 0 C-N-CA 123.222 2.615 . . . . 0.0 115.084 -178.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -59.78 -35.49 74.75 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 115.212 1.56 . . . . 0.0 115.212 -173.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -89.7 3.08 53.85 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -175.215 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.684 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 16.9 m95 -101.11 153.11 19.86 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.628 -171.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -108.38 124.4 50.31 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.8 p -90.82 126.61 36.08 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -176.098 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.444 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 54.1 t-80 -146.21 115.13 6.93 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 123.002 0.521 . . . . 0.0 110.086 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.25 3.9 mpt_? 53.58 59.14 4.53 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 174.628 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . 0.495 ' HB3' ' CD1' ' A' ' 127' ' ' TYR . 10.5 m-20 62.65 24.83 14.78 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.446 174.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -145.67 148.01 32.6 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . . . . . . . . . 7.3 t -130.78 134.48 46.9 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -176.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.444 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 11.8 m-85 -111.77 149.87 31.09 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -170.765 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.499 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 45.3 t-80 -129.52 116.94 19.68 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 172.619 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.01 93.57 3.87 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 174.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.711 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 13.3 m -77.8 107.76 10.54 Favored 'General case' 0 N--CA 1.416 -2.159 0 CA-C-N 115.306 -0.861 . . . . 0.0 108.696 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.412 HE22 ' ND2' ' A' ' 62' ' ' ASN . 11.5 mm100 -83.55 13.92 4.17 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.603 0.716 . . . . 0.0 111.15 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.464 HG23 ' CH2' ' A' ' 120' ' ' TRP . 5.7 m -100.62 158.32 3.99 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.149 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 13.2 m -109.97 151.59 26.93 Favored 'General case' 0 C--N 1.294 -1.81 0 C-N-CA 118.776 -1.17 . . . . 0.0 114.091 -171.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -167.09 174.66 8.11 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 127.39 2.276 . . . . 0.0 108.426 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.5 p -86.37 171.89 10.83 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 107.443 -1.318 . . . . 0.0 107.443 170.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -56.54 -52.99 62.68 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -174.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -31.26 70.38 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.956 0.408 . . . . 0.0 111.779 -175.609 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -70.23 -45.25 66.89 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.888 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.88 -32.04 82.83 Favored Glycine 0 C--N 1.341 0.824 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 5.0 tt -56.42 -51.21 69.24 Favored 'General case' 0 C--O 1.242 0.682 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 176.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.1 t -67.8 -33.24 60.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.839 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -60.11 -37.06 78.87 Favored 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 82.9 m -65.32 -42.35 93.07 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -61.16 -27.73 68.61 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.194 177.122 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -58.64 -34.98 78.89 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.576 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -95.73 8.93 42.09 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 122.26 -0.553 . . . . 0.0 109.704 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.8 43.67 93.58 Favored Glycine 0 CA--C 1.503 -0.68 0 N-CA-C 109.695 -1.362 . . . . 0.0 109.695 -175.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -130.05 174.91 9.33 Favored 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 -177.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -119.29 150.83 39.47 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 118.454 0.57 . . . . 0.0 110.972 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 25.9 tp -65.6 124.74 23.17 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 175.404 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.1 tpt -29.98 120.01 0.17 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 -169.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -109.3 110.6 21.82 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 114.191 -1.368 . . . . 0.0 107.505 176.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.9 mt -96.96 117.66 41.93 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -175.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -100.2 -25.1 14.38 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -137.05 160.42 39.01 Favored 'General case' 0 CA--C 1.5 -0.973 0 CA-C-O 120.669 0.271 . . . . 0.0 110.77 -175.085 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -33.97 74.93 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.282 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.3 mp0 -58.6 -29.39 66.42 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.04 178.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -62.17 -54.45 40.86 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.639 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 58.1 mt -65.28 -26.01 67.9 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.355 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -62.9 -41.6 99.49 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -72.45 -28.06 62.7 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.588 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -64.11 -50.75 67.03 Favored 'General case' 0 C--O 1.18 -2.603 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 175.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.639 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 51.1 mt -54.86 -35.18 63.74 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 122.878 0.471 . . . . 0.0 111.974 -178.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.04 -42.34 73.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.296 -0.411 . . . . 0.0 112.102 175.18 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.6 p -81.63 -26.43 34.82 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.204 0.526 . . . . 0.0 112.283 -176.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.588 HG12 ' O ' ' A' ' 53' ' ' LEU . 35.4 mm -64.08 -47.36 90.56 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.261 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 tptt 67.1 -68.98 0.14 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.689 1.196 . . . . 0.0 112.62 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -65.48 -47.59 75.55 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -175.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 96.0 mttt 75.17 -39.28 0.4 Allowed 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.639 1.176 . . . . 0.0 113.923 177.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -73.29 37.84 0.09 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -173.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.566 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 60.9 m-80 -128.0 -163.1 1.23 Allowed 'General case' 0 C--N 1.277 -2.578 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 174.156 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.626 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 50.3 m -139.16 119.54 13.81 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 176.302 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.566 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 6.2 m-85 -120.91 116.17 24.62 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -177.01 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . 0.418 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 71.5 m95 -61.81 138.85 58.37 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 123.596 0.758 . . . . 0.0 111.492 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.14 175.63 4.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.149 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 168.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.621 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.04 47.96 2.33 Favored Glycine 0 C--O 1.209 -1.438 0 C-N-CA 120.784 -0.722 . . . . 0.0 114.375 -174.994 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.7 mt -114.25 121.72 44.57 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 123.283 0.633 . . . . 0.0 111.843 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -129.4 134.29 47.79 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.226 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -87.39 112.82 22.52 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 179.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.506 ' OG1' ' HE2' ' A' ' 78' ' ' LYS . 46.6 p -99.44 121.11 40.67 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.128 -172.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 63.4 mt -120.75 146.26 43.13 Favored Pre-proline 0 C--N 1.303 -1.417 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.731 176.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -85.25 126.16 9.74 Favored 'Cis proline' 0 C--O 1.242 0.701 0 C-N-CA 123.582 -1.424 . . . . 0.0 110.976 -3.554 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.9 t70 179.03 -46.38 0.01 OUTLIER 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -177.381 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 46.5 mtm 71.73 8.25 6.08 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.347 1.459 . . . . 0.0 113.755 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -95.93 146.67 24.41 Favored 'General case' 0 C--N 1.295 -1.782 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.173 173.639 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 77.5 m95 -86.93 119.93 27.67 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 175.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.506 ' HE2' ' OG1' ' A' ' 71' ' ' THR . 55.9 mttm -113.22 152.29 29.94 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -177.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.621 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 42.5 m95 -98.03 175.91 5.95 Favored 'General case' 0 C--N 1.288 -2.094 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 46.0 pt -71.93 -23.2 21.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 120.95 0.405 . . . . 0.0 111.334 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.402 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 32.3 p-10 -85.69 -9.68 56.83 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.628 0.728 . . . . 0.0 109.69 179.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.21 -0.08 44.11 Favored Glycine 0 CA--C 1.495 -1.18 0 CA-C-N 115.39 -0.823 . . . . 0.0 112.382 172.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.1 m -69.8 168.22 15.56 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 28.8 m -108.94 134.43 51.61 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.622 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.411 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 44.3 tp -54.45 142.27 27.85 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 124.84 1.256 . . . . 0.0 114.047 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -96.12 97.1 9.3 Favored 'General case' 0 N--CA 1.432 -1.335 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 169.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.1 m -70.65 -6.11 34.53 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.222 0.534 . . . . 0.0 111.328 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -78.3 -6.21 54.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.079 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.3 m -78.74 -54.47 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.31 0 C-N-CA 119.364 -0.934 . . . . 0.0 112.195 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 91.5 mt -157.37 -178.16 7.14 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.577 0.751 . . . . 0.0 109.188 -174.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.6 98.47 0.37 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -177.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 8.8 mt -139.23 103.54 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 173.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' THR . . . . . 0.414 HG23 ' H ' ' A' ' 95' ' ' ASP . 9.7 m -76.05 132.31 40.03 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.086 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -106.26 12.61 44.14 Favored Glycine 0 CA--C 1.489 -1.559 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -177.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . 0.414 ' H ' HG23 ' A' ' 93' ' ' THR . 7.2 p-10 -140.97 96.73 3.05 Favored 'General case' 0 C--N 1.285 -2.219 0 CA-C-O 121.557 0.694 . . . . 0.0 109.64 176.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.1 t -148.43 -20.48 0.33 Allowed 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.396 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 56.81 82.08 0.12 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.983 0.913 . . . . 0.0 112.888 -177.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -157.0 178.06 10.8 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -108.83 26.17 10.89 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 123.137 1.446 . . . . 0.0 107.475 179.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.413 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 19.1 m -66.75 153.42 43.33 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -173.876 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -132.88 145.71 51.17 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 113.606 -1.634 . . . . 0.0 107.0 173.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -92.16 148.24 22.31 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -171.059 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.49 153.32 42.5 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.48 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.626 ' O ' ' HA ' ' A' ' 63' ' ' SER . 14.2 mm -77.7 120.14 27.75 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 174.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 34.1 t -134.97 94.21 3.12 Favored 'General case' 0 N--CA 1.421 -1.881 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.24 -126.41 8.09 Favored Glycine 0 N--CA 1.429 -1.825 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -102.3 8.39 40.38 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -126.74 166.83 16.66 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.263 -173.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 t -104.85 133.51 48.82 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.753 0 N-CA-C 104.766 -2.309 . . . . 0.0 104.766 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 43.2 p -127.98 170.47 12.83 Favored 'General case' 0 C--N 1.278 -2.501 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.413 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 11.3 p90 -130.35 125.28 34.23 Favored 'General case' 0 C--N 1.296 -1.758 0 C-N-CA 119.619 -0.832 . . . . 0.0 112.598 178.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -118.06 170.82 8.54 Favored 'General case' 0 C--N 1.294 -1.824 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.712 -172.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 19.1 m -72.0 127.84 33.82 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 170.202 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.6 m -50.71 -22.14 1.95 Allowed 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 125.495 1.518 . . . . 0.0 113.553 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.51 7.43 9.93 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 124.387 1.075 . . . . 0.0 111.561 -175.24 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 18.5 p -92.13 140.38 29.69 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.582 -0.699 . . . . 0.0 111.777 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -78.65 90.42 4.58 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.8 0.81 . . . . 0.0 109.294 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -126.61 -178.58 4.42 Favored 'General case' 0 C--O 1.196 -1.746 0 CA-C-N 114.94 -1.027 . . . . 0.0 108.991 -178.283 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.711 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.7 mpt_? -100.85 -175.44 2.89 Favored 'General case' 0 C--N 1.283 -2.293 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 -175.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.464 ' CH2' HG23 ' A' ' 23' ' ' VAL . 26.9 p90 -154.27 169.69 23.05 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 119.492 1.042 . . . . 0.0 112.199 -176.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 74.2 mt -122.22 125.74 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 CA-C-O 121.4 0.619 . . . . 0.0 109.855 178.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 87.0 m -104.1 142.82 33.8 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.448 -0.796 . . . . 0.0 108.929 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -117.93 132.76 56.37 Favored 'General case' 0 N--CA 1.413 -2.305 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 172.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.524 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 42.9 tttp -109.98 106.49 16.03 Favored 'General case' 0 C--N 1.251 -3.7 0 N-CA-C 104.048 -2.575 . . . . 0.0 104.048 173.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -83.53 124.73 31.04 Favored 'General case' 0 N--CA 1.41 -2.437 0 CA-C-N 114.357 -1.292 . . . . 0.0 109.902 -170.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.497 ' HG ' ' H ' ' A' ' 4' ' ' LEU . 1.5 mm? -71.89 -30.94 65.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.264 -175.489 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' TYR . . . . . 0.495 ' CD1' ' HB3' ' A' ' 15' ' ' ASP . 20.0 m-85 -93.2 85.46 5.05 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 122.391 1.091 . . . . 0.0 112.527 176.294 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 51.6 p-80 -140.17 139.17 35.66 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 103.528 -2.768 . . . . 0.0 103.528 176.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 59.6 mm-40 56.78 -155.63 0.31 Allowed 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.698 0.624 . . . . 0.0 109.32 -176.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.2 m -146.29 138.9 25.36 Favored 'General case' 0 C--N 1.279 -2.486 0 N-CA-C 105.242 -2.133 . . . . 0.0 105.242 172.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.442 HD23 ' H ' ' A' ' 131' ' ' LEU . 1.7 pt? -61.93 101.27 0.2 Allowed 'General case' 0 C--O 1.248 1.018 0 CA-C-O 121.924 0.869 . . . . 0.0 109.254 176.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 19.8 m -99.72 159.93 14.68 Favored 'General case' 0 N--CA 1.422 -1.844 0 CA-C-N 114.415 -1.266 . . . . 0.0 110.846 -173.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -116.56 -77.93 0.57 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.174 176.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -146.06 144.03 29.78 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 -178.759 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 47.3 t -91.87 -61.5 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 175.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 85.72 -49.6 4.18 Favored Glycine 0 N--CA 1.442 -0.92 0 CA-C-N 116.042 -0.526 . . . . 0.0 114.055 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 66.53 -82.84 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.921 0.888 . . . . 0.0 109.676 -175.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -151.2 16.79 0.89 Allowed Glycine 0 N--CA 1.433 -1.559 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 176.297 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 . . . . . 0 N--CA 1.436 -1.152 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.489 -178.888 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.0 m . . . . . 0 C--O 1.238 0.47 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . 0.617 ' HA ' ' OH ' ' A' ' 127' ' ' TYR . . . 72.12 138.37 0.05 OUTLIER 'General case' 0 C--N 1.353 0.725 0 C-N-CA 124.616 1.166 . . . . 0.0 112.893 177.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt 74.22 137.24 0.06 Allowed 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 122.11 0.957 . . . . 0.0 113.434 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.437 ' H ' ' CD2' ' A' ' 126' ' ' LEU . 3.6 mp -115.83 -159.35 0.71 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.409 -1.269 . . . . 0.0 107.792 -177.611 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -94.31 145.03 25.03 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 118.419 0.554 . . . . 0.0 111.189 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 71.0 m -113.25 164.08 16.55 Favored Pre-proline 0 C--N 1.301 -1.511 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.466 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 38.5 Cg_exo -60.75 157.67 36.6 Favored 'Trans proline' 0 C--N 1.368 1.573 0 C-N-CA 121.448 1.432 . . . . 0.0 110.956 174.028 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -44.13 -45.35 8.17 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -92.47 2.18 56.82 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.513 -172.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.466 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 23.9 m95 -99.98 126.87 46.22 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.793 0.806 . . . . 0.0 111.788 -173.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.2 tp -84.69 119.41 25.22 Favored 'General case' 0 N--CA 1.412 -2.347 0 CA-C-N 113.753 -1.567 . . . . 0.0 108.081 -175.513 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.6 t -92.72 130.79 38.23 Favored 'General case' 0 C--N 1.272 -2.781 0 CA-C-O 120.897 0.38 . . . . 0.0 111.092 -173.078 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.443 ' CE1' ' HG2' ' A' ' 14' ' ' ARG . 48.3 t-80 -153.31 130.03 10.83 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 123.212 0.605 . . . . 0.0 109.696 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.443 ' HG2' ' CE1' ' A' ' 13' ' ' HIS . 24.0 mmt180 65.11 -81.04 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.439 1.495 . . . . 0.0 113.011 178.677 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -157.77 26.07 0.27 Allowed 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 -174.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -141.98 163.75 32.03 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.441 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.669 ' SG ' HD13 ' A' ' 126' ' ' LEU . 13.1 m -123.96 131.07 53.51 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 176.402 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.416 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 22.6 m-85 -111.15 135.73 51.23 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 120.999 0.428 . . . . 0.0 111.907 -175.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -121.53 102.08 8.02 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 173.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -81.1 95.18 2.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.74 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 9.4 m -77.77 108.03 10.71 Favored 'General case' 0 N--CA 1.414 -2.248 0 CA-C-N 115.416 -0.811 . . . . 0.0 108.98 -178.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.505 HE22 ' ND2' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -83.34 14.79 3.34 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.997 0.919 . . . . 0.0 112.67 -179.409 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.42 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.4 m -105.7 158.89 6.02 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.801 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 178.52 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -111.4 148.38 33.18 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -171.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -158.15 -176.69 6.06 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 127.379 2.272 . . . . 0.0 107.825 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.7 p -84.68 176.62 8.45 Favored 'General case' 0 C--O 1.258 1.525 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 171.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.9 t90 -63.02 -47.0 84.93 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 43.1 mt-10 -67.76 -38.01 82.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.946 -177.013 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.33 -46.07 85.13 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.456 -0.498 . . . . 0.0 111.429 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.9 -35.66 92.33 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 120.165 -1.017 . . . . 0.0 111.574 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.441 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 3.2 tm? -55.39 -52.16 64.45 Favored 'General case' 0 C--O 1.249 1.043 0 C-N-CA 123.797 0.839 . . . . 0.0 108.999 176.005 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 84.8 t -68.1 -32.59 56.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.971 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.8 -36.35 80.86 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.783 177.179 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.0 m -69.38 -40.37 77.47 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -60.44 -29.42 69.0 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.369 0.604 . . . . 0.0 109.589 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -60.76 -30.24 72.16 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.248 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -96.8 1.86 51.21 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 117.245 0.522 . . . . 0.0 111.027 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.0 53.28 9.55 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 108.53 -1.828 . . . . 0.0 108.53 -172.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -147.3 177.28 9.34 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 11.2 p -120.85 159.56 25.24 Favored 'General case' 0 C--N 1.284 -2.28 0 C-N-CA 122.917 0.487 . . . . 0.0 110.402 -176.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.7 tp -73.97 131.62 41.59 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 174.635 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.4 tpt -29.38 122.7 0.15 Allowed 'General case' 0 N--CA 1.506 2.333 0 N-CA-C 116.77 2.137 . . . . 0.0 116.77 -170.392 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.422 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 2.9 mm? -112.94 108.09 16.89 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.45 HD12 HD13 ' A' ' 50' ' ' LEU . 54.4 mt -83.38 118.15 30.43 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.7 0 O-C-N 122.211 -0.305 . . . . 0.0 110.556 -175.617 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -79.73 -45.79 18.26 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.16 -178.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -154.15 179.85 8.56 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -174.293 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.3 -36.27 79.08 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -60.3 -27.89 67.67 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.498 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -68.17 -52.13 38.05 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.551 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.4 mt -66.22 -24.26 66.58 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -64.71 -35.93 82.65 Favored 'General case' 0 N--CA 1.393 -3.285 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -72.1 -31.74 66.34 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.265 175.198 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.591 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.4 mm? -64.21 -52.67 57.69 Favored 'General case' 0 C--O 1.192 -1.922 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.922 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.551 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 45.4 mt -54.77 -40.63 69.59 Favored 'General case' 0 C--O 1.252 1.233 0 C-N-CA 123.178 0.591 . . . . 0.0 112.246 -177.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -70.2 -36.8 74.85 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 178.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.8 p -81.96 -33.55 30.19 Favored 'General case' 0 C--N 1.31 -1.152 0 C-N-CA 120.824 -0.351 . . . . 0.0 111.451 -178.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.591 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.1 mm -56.07 -45.97 80.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.609 0 C-N-CA 123.878 0.871 . . . . 0.0 109.545 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? 66.12 -68.64 0.13 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.435 1.094 . . . . 0.0 113.093 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -60.36 -38.64 84.5 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 124.656 1.183 . . . . 0.0 114.182 -174.222 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.471 ' HE2' ' OD2' ' A' ' 107' ' ' ASP . 41.8 mmtm 71.94 -53.34 0.69 Allowed 'General case' 0 C--O 1.212 -0.913 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 175.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -67.3 35.16 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 126.321 1.848 . . . . 0.0 114.494 -171.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.505 ' ND2' HE22 ' A' ' 22' ' ' GLN . 93.2 m-20 -127.49 -173.61 2.96 Favored 'General case' 0 C--N 1.273 -2.749 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 177.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.681 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 50.2 m -142.66 121.9 13.03 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 177.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.452 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 3.0 m-85 -123.64 117.6 25.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -176.463 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 78.9 m95 -60.77 139.02 58.05 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 123.53 0.732 . . . . 0.0 111.207 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -119.48 176.25 3.53 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 170.51 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.513 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.94 48.41 2.7 Favored Glycine 0 C--O 1.22 -0.745 0 CA-C-N 118.736 0.698 . . . . 0.0 114.128 -174.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 48.3 mt -113.1 115.42 28.28 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 123.295 0.638 . . . . 0.0 112.105 -179.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -126.22 146.81 49.83 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 173.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.441 ' HD2' ' O ' ' A' ' 98' ' ' ASN . 30.0 t80 -96.37 113.19 24.76 Favored 'General case' 0 C--N 1.277 -2.582 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -177.111 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 17.1 p -107.2 127.66 53.72 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.69 -175.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.434 HD22 ' CZ ' ' A' ' 70' ' ' TYR . 86.1 mt -120.09 150.59 51.48 Favored Pre-proline 0 C--N 1.305 -1.359 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -85.11 141.75 32.95 Favored 'Cis proline' 0 C--O 1.24 0.599 0 C-N-CA 123.996 -1.252 . . . . 0.0 111.581 -3.031 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.406 ' OD2' ' HB2' ' A' ' 76' ' ' ASN . 22.0 t70 174.48 -36.34 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.3 mpt? 63.82 15.41 9.04 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 113.418 -1.719 . . . . 0.0 113.707 176.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . 0.406 ' HB2' ' OD2' ' A' ' 74' ' ' ASP . 10.5 m120 -124.71 165.62 17.62 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 174.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -92.62 138.14 31.76 Favored 'General case' 0 C--N 1.281 -2.399 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -177.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -118.87 152.42 36.31 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.617 ' HB2' ' OD1' ' A' ' 81' ' ' ASN . 23.7 m95 -98.2 170.76 8.66 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 115.463 -0.79 . . . . 0.0 108.909 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 48.1 pt -73.23 -12.33 15.47 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.882 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.617 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 33.3 p-10 -86.17 -8.08 58.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.243 0.544 . . . . 0.0 109.665 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.39 6.48 57.54 Favored Glycine 0 CA--C 1.523 0.577 0 CA-C-N 114.903 -1.044 . . . . 0.0 113.473 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.5 t -96.05 174.16 7.06 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -178.286 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 59.3 m -106.55 145.55 31.72 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 121.256 0.551 . . . . 0.0 109.864 177.138 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 28.4 tp -54.23 144.21 20.77 Favored 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 125.987 1.715 . . . . 0.0 113.41 178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -92.34 89.83 6.99 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 170.192 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.8 m -70.37 -12.24 61.45 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.486 -175.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -77.66 -10.66 59.64 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.435 -176.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.4 m -75.46 -51.28 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -176.083 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.0 mt -155.21 -177.96 6.91 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -173.557 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.98 102.67 0.51 Allowed 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 114.72 1.378 . . . . 0.0 114.72 -179.064 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 7.7 mt -143.47 98.65 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 171.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.1 m -60.49 127.69 32.95 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.364 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.96 -43.8 5.89 Favored Glycine 0 N--CA 1.414 -2.808 0 N-CA-C 108.78 -1.728 . . . . 0.0 108.78 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -85.96 85.44 7.37 Favored 'General case' 0 N--CA 1.428 -1.575 0 CA-C-O 122.727 1.251 . . . . 0.0 110.925 177.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.1 t -122.16 -32.33 3.7 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.394 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 56.06 34.36 23.62 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.935 0.894 . . . . 0.0 111.811 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . 0.441 ' O ' ' HD2' ' A' ' 70' ' ' TYR . 35.1 m-80 -108.57 -171.7 1.91 Allowed 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.829 176.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -119.52 25.75 9.85 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-O 123.019 1.39 . . . . 0.0 107.299 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.422 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 22.9 t -73.9 157.65 35.89 Favored 'General case' 0 C--N 1.298 -1.65 0 CA-C-N 113.854 -1.521 . . . . 0.0 111.544 -174.323 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 72.2 m -121.59 144.89 48.48 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . 0.406 ' HA ' ' HA ' ' A' ' 111' ' ' PHE . . . -95.31 150.48 20.21 Favored 'General case' 0 C--O 1.251 1.15 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -173.883 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.19 154.43 43.85 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 124.571 1.148 . . . . 0.0 109.664 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.681 ' O ' ' HA ' ' A' ' 63' ' ' SER . 14.1 mm -77.65 116.27 20.87 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.354 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 173.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 6.4 t -129.3 93.11 3.49 Favored 'General case' 0 N--CA 1.405 -2.685 0 N-CA-C 106.749 -1.574 . . . . 0.0 106.749 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 87.79 -133.51 11.85 Favored Glycine 0 N--CA 1.431 -1.668 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . 0.471 ' OD2' ' HE2' ' A' ' 60' ' ' LYS . 8.1 m-20 -97.73 15.05 24.79 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 174.272 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -125.38 168.99 12.79 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.706 -174.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.2 t -115.53 133.32 62.25 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.003 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 173.48 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.7 p -129.15 167.79 17.08 Favored 'General case' 0 C--N 1.278 -2.514 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.422 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 6.2 p90 -122.74 128.08 50.04 Favored 'General case' 0 C--N 1.285 -2.234 0 CA-C-O 121.444 0.64 . . . . 0.0 111.105 176.78 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 21.4 mm-40 -120.81 170.02 9.86 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.805 -172.402 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.9 m -65.78 128.41 35.89 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 170.25 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 11.7 m -61.21 -18.91 60.64 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.242 0.617 . . . . 0.0 112.292 -172.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -88.84 0.16 56.8 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.935 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 64.7 p -80.32 150.09 30.05 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.989 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -76.76 106.15 8.25 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.142 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 78.2 m-20 -143.67 172.46 12.79 Favored 'General case' 0 CA--C 1.489 -1.372 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.74 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.6 mpt_? -93.74 -174.82 3.56 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 -177.398 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 24.4 p90 -155.36 167.56 29.98 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 119.897 1.226 . . . . 0.0 111.619 -177.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 79.5 mt -124.06 123.55 66.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-O 121.234 0.54 . . . . 0.0 110.052 178.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 79.0 m -100.84 138.93 37.23 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.103 176.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.577 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.0 pt20 -123.43 140.49 52.95 Favored 'General case' 0 N--CA 1.413 -2.293 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 173.3 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -109.5 124.31 50.86 Favored 'General case' 0 C--N 1.246 -3.91 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 175.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.446 ' HG2' ' O ' ' A' ' 127' ' ' TYR . 41.1 tt0 -72.22 114.22 10.1 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 177.166 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.669 HD13 ' SG ' ' A' ' 17' ' ' CYS . 13.6 tp -72.83 -24.15 60.86 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 114.274 -1.33 . . . . 0.0 110.224 -171.03 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' TYR . . . . . 0.617 ' OH ' ' HA ' ' A' ' 2' ' ' ALA . 33.4 m-85 -94.89 116.75 29.1 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.964 172.917 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -99.8 43.55 1.05 Allowed 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -173.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -75.07 69.77 2.0 Allowed 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.252 1.025 . . . . 0.0 111.96 -174.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 61.0 m -160.59 -51.55 0.05 OUTLIER 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 105.955 -1.868 . . . . 0.0 105.955 176.63 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.4 mt -99.7 23.02 10.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 177.537 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 10.2 p -73.71 110.9 8.37 Favored 'General case' 0 N--CA 1.418 -2.037 0 CA-C-N 113.936 -1.484 . . . . 0.0 109.151 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.2 m120 66.6 -83.25 0.03 OUTLIER 'General case' 0 CA--C 1.489 -1.382 0 C-N-CA 124.273 1.029 . . . . 0.0 111.216 -175.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -142.58 142.58 32.18 Favored 'General case' 0 N--CA 1.42 -1.945 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -174.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 43.3 t -88.09 -23.71 6.39 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.613 0 CA-C-O 121.729 0.776 . . . . 0.0 109.013 179.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 91.73 44.48 4.22 Favored Glycine 0 N--CA 1.431 -1.668 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.015 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -68.66 147.36 52.0 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.208 0.527 . . . . 0.0 110.837 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 120.63 -27.05 6.69 Favored Glycine 0 C--N 1.293 -1.85 0 N-CA-C 109.611 -1.395 . . . . 0.0 109.611 -178.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 57.2 t-80 . . . . . 0 C--O 1.243 0.746 0 C-N-CA 124.266 1.027 . . . . 0.0 110.36 179.648 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 CA--C 1.551 0.981 0 CA-C-O 121.435 0.636 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.67 96.47 6.52 Favored 'General case' 0 N--CA 1.434 -1.242 0 O-C-N 121.857 -0.527 . . . . 0.0 109.894 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.522 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 15.5 mtpt -37.46 145.88 0.06 Allowed 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 126.482 1.913 . . . . 0.0 114.999 174.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.485 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 4.8 mp -107.86 -154.91 0.54 Allowed 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 173.902 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -86.71 141.03 29.2 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 118.621 0.646 . . . . 0.0 112.178 -177.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.9 m -120.68 156.06 56.41 Favored Pre-proline 0 C--N 1.309 -1.186 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.955 177.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.482 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 15.4 Cg_exo -66.36 164.41 28.45 Favored 'Trans proline' 0 CA--C 1.55 1.279 0 C-N-CA 121.733 1.622 . . . . 0.0 111.344 174.445 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . 0.421 ' HG3' ' N ' ' A' ' 9' ' ' ASP . 11.4 pt20 -50.73 -46.1 58.92 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -173.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.421 ' N ' ' HG3' ' A' ' 8' ' ' GLN . 22.4 m-20 -92.74 24.29 3.67 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 120.749 0.309 . . . . 0.0 111.282 -173.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.482 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 26.6 m95 -122.17 131.98 54.22 Favored 'General case' 0 C--N 1.295 -1.802 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.527 -177.74 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.35 135.97 33.12 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 177.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.1 t -98.48 123.3 42.55 Favored 'General case' 0 C--N 1.292 -1.92 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.112 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 43.0 t-80 -130.39 108.15 9.77 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.938 -0.476 . . . . 0.0 110.949 179.147 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.522 ' O ' ' HG3' ' A' ' 3' ' ' LYS . 42.0 mtm180 59.59 -68.63 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 126.451 1.901 . . . . 0.0 113.642 177.236 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -147.8 19.66 1.15 Allowed 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.427 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.467 ' HG3' ' HA ' ' A' ' 125' ' ' GLU . 3.9 mppt? -150.87 151.99 33.03 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.231 0.612 . . . . 0.0 109.926 176.672 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.675 ' SG ' HD11 ' A' ' 126' ' ' LEU . 8.3 m -108.22 136.71 47.43 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 177.507 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.412 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 13.6 m-85 -113.27 142.0 46.34 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 118.669 0.668 . . . . 0.0 111.546 -176.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . 0.425 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 35.1 t60 -128.15 112.57 14.7 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 175.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.8 t -94.12 98.57 8.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.163 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.749 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 4.8 m -77.69 117.86 19.5 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.423 HE22 ' ND2' ' A' ' 62' ' ' ASN . 14.3 mm100 -86.97 14.39 7.46 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.855 0.836 . . . . 0.0 111.726 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.442 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 7.2 m -111.44 156.31 12.61 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.295 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 55.1 m -103.51 158.98 15.98 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -173.258 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 36.5 m-20 -162.96 170.98 17.25 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 127.716 2.407 . . . . 0.0 107.896 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.7 p -81.64 165.62 20.9 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 170.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -58.42 -50.95 71.86 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.737 0.699 . . . . 0.0 112.051 -174.53 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 38.6 mt-10 -66.26 -32.01 73.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.596 0.712 . . . . 0.0 110.793 -176.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -70.42 -44.56 67.65 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.454 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.33 -35.22 91.77 Favored Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.441 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 2.7 tm? -55.68 -52.26 64.45 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.77 -35.06 74.27 Favored 'Isoleucine or valine' 0 C--O 1.244 0.778 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.68 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.05 -36.5 81.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.726 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.6 m -67.44 -42.6 82.86 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 176.557 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.75 -23.11 67.03 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.217 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.96 -33.91 87.12 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.169 176.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -93.94 10.22 34.26 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.284 -0.539 . . . . 0.0 110.056 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 40.85 84.52 Favored Glycine 0 CA--C 1.495 -1.176 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.541 ' HB3' ' O ' ' A' ' 123' ' ' GLN . . . -131.28 176.79 7.99 Favored 'General case' 0 N--CA 1.416 -2.125 0 CA-C-N 114.723 -0.738 . . . . 0.0 109.29 -176.321 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -117.62 162.14 18.51 Favored 'General case' 0 C--N 1.284 -2.269 0 C-N-CA 123.24 0.616 . . . . 0.0 109.571 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.3 tp -81.1 121.95 26.73 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.8 tpt -21.05 118.42 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 117.291 2.33 . . . . 0.0 117.291 -168.633 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.459 HD21 ' NE2' ' A' ' 123' ' ' GLN . 3.2 mm? -112.09 105.9 14.39 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.816 1.246 . . . . 0.0 108.127 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.407 ' HB ' ' CH2' ' A' ' 79' ' ' TRP . 24.2 mt -93.73 130.43 42.71 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -175.406 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -110.08 -26.36 9.73 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.994 176.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -136.96 167.25 21.85 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.291 -173.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -37.55 75.02 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.162 0.985 . . . . 0.0 108.556 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.571 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 6.6 pt-20 -60.3 -27.29 67.19 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-O 121.197 0.522 . . . . 0.0 110.688 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.54 -54.62 33.26 Favored 'General case' 0 N--CA 1.422 -1.842 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.631 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 51.2 mt -68.44 -27.73 66.44 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.571 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 16.5 ptt180 -66.02 -34.81 78.95 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.564 -0.854 . . . . 0.0 108.901 177.102 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -72.44 -33.69 67.25 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 177.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.644 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -61.11 -49.46 77.21 Favored 'General case' 0 CA--C 1.48 -1.717 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 54.2 mt -56.18 -34.51 66.28 Favored 'General case' 0 C--N 1.314 -0.951 0 O-C-N 123.563 0.539 . . . . 0.0 112.092 -178.664 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.69 -44.58 85.75 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.86 0.362 . . . . 0.0 110.66 175.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 35.1 p -76.6 -27.55 55.81 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.019 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.644 HG12 ' O ' ' A' ' 53' ' ' LEU . 42.9 mm -66.79 -55.77 16.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.6 tptm 66.05 -63.23 0.24 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.855 1.262 . . . . 0.0 113.492 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -65.52 -39.93 92.37 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 122.69 0.396 . . . . 0.0 111.583 -175.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.452 ' H ' HG22 ' A' ' 57' ' ' ILE . 94.6 mttt 70.99 -47.3 0.65 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 173.219 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -67.3 -1.0 3.98 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 115.359 1.615 . . . . 0.0 115.359 -170.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 61.7 m-80 -82.04 -160.98 0.4 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.215 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.441 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 18.9 m -142.63 114.03 7.85 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 2.7 m-85 -121.61 118.52 29.41 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 117.636 0.198 . . . . 0.0 110.696 -175.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 74.9 m95 -62.33 142.91 57.54 Favored 'General case' 0 C--N 1.312 -1.048 0 C-N-CA 123.239 0.616 . . . . 0.0 112.018 179.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.15 176.28 4.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 168.106 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.57 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.15 47.06 2.55 Favored Glycine 0 C--O 1.217 -0.92 0 CA-C-N 118.71 0.686 . . . . 0.0 114.309 -174.967 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.9 mt -112.13 118.56 35.69 Favored 'General case' 0 CA--C 1.494 -1.184 0 C-N-CA 123.818 0.847 . . . . 0.0 111.209 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -127.39 136.08 51.36 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.08 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -90.46 112.7 24.43 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 177.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.592 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 1.4 p -92.65 115.56 28.22 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.04 -175.184 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.404 HD23 ' O ' ' A' ' 71' ' ' THR . 40.0 mt -120.83 140.59 30.96 Favored Pre-proline 0 C--N 1.318 -0.778 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.439 175.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -83.69 130.69 16.3 Favored 'Cis proline' 0 C--O 1.245 0.838 0 C-N-CA 123.445 -1.481 . . . . 0.0 110.845 -3.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.592 ' HB3' ' O ' ' A' ' 71' ' ' THR . 13.4 t70 176.89 -44.2 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 -174.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.475 ' HG2' ' OE1' ' A' ' 97' ' ' GLU . 83.2 mtp 70.41 21.98 5.45 Favored 'General case' 0 CA--C 1.497 -1.069 0 CA-C-N 114.387 -1.279 . . . . 0.0 114.174 173.024 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -117.32 157.26 26.41 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.575 174.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -94.01 107.05 19.0 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 171.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -105.28 145.98 29.96 Favored 'General case' 0 C--N 1.275 -2.64 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.807 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.57 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 47.8 m95 -87.25 165.02 15.98 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 176.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 47.0 pt -67.19 -17.83 23.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.541 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 32.7 p-10 -85.9 -9.59 56.68 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.171 0.51 . . . . 0.0 109.742 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.75 8.23 55.95 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.649 -0.705 . . . . 0.0 114.234 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.2 t -85.37 174.8 9.29 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 117.537 0.668 . . . . 0.0 109.911 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 88.0 m -101.18 140.68 35.14 Favored 'General case' 0 N--CA 1.42 -1.944 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.44 HD13 HD13 ' A' ' 92' ' ' ILE . 40.8 tp -53.92 132.56 42.21 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 178.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -92.47 81.86 4.87 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 170.657 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.4 p -71.74 -11.99 61.09 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.361 0.601 . . . . 0.0 111.19 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -77.34 -1.45 30.0 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.664 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 33.7 m -80.7 -47.69 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.446 174.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.5 mt -154.86 177.79 10.89 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.528 0.731 . . . . 0.0 109.147 -175.3 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -67.52 117.05 8.94 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -175.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.44 HD13 HD13 ' A' ' 85' ' ' LEU . 8.8 mt -149.86 114.57 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 172.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.7 m -69.88 128.66 37.15 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -81.45 -30.69 35.95 Favored Glycine 0 N--CA 1.418 -2.503 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -174.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -112.7 117.37 32.04 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.5 t -142.73 -19.89 0.67 Allowed 'General case' 0 C--N 1.289 -2.025 0 C-N-CA 119.041 -1.064 . . . . 0.0 111.199 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . 0.475 ' OE1' ' HG2' ' A' ' 75' ' ' MET . 10.2 mm-40 49.86 64.77 1.64 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.732 0.777 . . . . 0.0 112.765 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -141.97 167.3 22.46 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.857 -174.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -90.54 29.14 1.34 Allowed 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 126.905 2.082 . . . . 0.0 107.48 175.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' SER . . . . . 0.43 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 21.7 t -91.43 151.24 20.89 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 113.738 -1.574 . . . . 0.0 113.51 -171.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 66.8 m -130.87 151.63 51.08 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 174.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -92.76 149.51 21.25 Favored 'General case' 0 C--O 1.251 1.139 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -173.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.1 148.15 36.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.396 1.078 . . . . 0.0 110.328 -178.172 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.441 ' O ' ' HA ' ' A' ' 63' ' ' SER . 12.1 mm -77.07 125.61 37.02 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 C-N-CA 124.348 1.059 . . . . 0.0 108.414 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 8.8 t -149.85 95.34 2.3 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 105.51 -143.19 15.65 Favored Glycine 0 C--N 1.296 -1.657 0 N-CA-C 109.083 -1.607 . . . . 0.0 109.083 -178.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -99.03 15.03 27.12 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -128.19 171.3 12.07 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.767 -173.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 10.5 t -104.21 142.46 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.654 0 N-CA-C 105.615 -1.995 . . . . 0.0 105.615 173.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.3 p -131.88 175.73 8.96 Favored 'General case' 0 C--N 1.278 -2.508 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 178.055 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . 0.43 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 19.4 p90 -138.9 139.04 37.93 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 119.229 0.922 . . . . 0.0 112.743 177.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -125.24 168.5 13.38 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 -177.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.0 m -66.9 136.2 55.01 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 174.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 33.8 m -57.62 -16.88 11.71 Favored 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -173.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -95.41 7.95 44.7 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 123.683 0.793 . . . . 0.0 110.491 -173.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 51.1 p -90.67 140.06 30.13 Favored 'General case' 0 N--CA 1.427 -1.576 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.893 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -75.93 106.5 7.55 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.449 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -141.25 172.22 12.98 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 124.077 0.951 . . . . 0.0 108.684 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.749 ' HB3' ' O ' ' A' ' 21' ' ' SER . 4.7 mpt_? -83.3 -179.68 7.45 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 15.3 p90 -154.56 161.95 41.38 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 118.092 -1.443 . . . . 0.0 112.375 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 82.0 mt -119.83 122.25 68.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.415 0.626 . . . . 0.0 110.282 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 79.4 m -100.46 148.81 24.34 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.955 177.081 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.541 ' O ' ' HB3' ' A' ' 39' ' ' ALA . 5.4 pt20 -125.98 139.05 53.75 Favored 'General case' 0 N--CA 1.418 -2.028 0 N-CA-C 106.733 -1.581 . . . . 0.0 106.733 172.306 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -109.51 109.04 19.73 Favored 'General case' 0 C--N 1.259 -3.343 0 N-CA-C 103.699 -2.704 . . . . 0.0 103.699 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.467 ' HA ' ' HG3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -63.72 116.44 5.72 Favored 'General case' 0 N--CA 1.424 -1.747 0 CA-C-O 122.17 0.986 . . . . 0.0 109.406 -176.98 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.675 HD11 ' SG ' ' A' ' 17' ' ' CYS . 12.4 tp -77.35 -35.68 54.4 Favored 'General case' 0 N--CA 1.415 -2.178 0 CA-C-N 113.923 -1.49 . . . . 0.0 108.188 -170.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -86.52 84.83 7.33 Favored 'General case' 0 N--CA 1.426 -1.625 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 168.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 21.6 m80 -74.34 115.88 14.36 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.259 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -81.2 91.03 6.11 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 25.7 m -95.6 -48.85 5.64 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.942 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.3 mt -67.46 136.8 55.2 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.927 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 32.0 t -100.96 120.35 40.04 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -99.85 16.4 23.87 Favored 'General case' 0 CA--C 1.489 -1.392 0 CA-C-O 121.889 0.852 . . . . 0.0 108.996 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -130.19 -176.85 4.08 Favored 'General case' 0 N--CA 1.406 -2.625 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.532 -175.641 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 41.6 t -142.89 67.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 N-CA-C 104.45 -2.426 . . . . 0.0 104.45 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 94.06 -87.3 1.12 Allowed Glycine 0 C--N 1.288 -2.128 0 CA-C-N 113.357 -1.747 . . . . 0.0 110.074 179.187 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -121.0 -72.02 0.71 Allowed 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 174.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -165.53 72.33 0.18 Allowed Glycine 0 N--CA 1.435 -1.392 0 C-N-CA 119.891 -1.147 . . . . 0.0 113.246 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 12.3 p80 . . . . . 0 C--N 1.31 -1.122 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 176.03 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 38.9 m . . . . . 0 C--O 1.244 0.78 0 N-CA-C 111.606 0.225 . . . . 0.0 111.606 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.71 150.58 22.15 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 120.4 0.143 . . . . 0.0 111.077 -177.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.42 ' HG2' ' CE1' ' A' ' 127' ' ' TYR . 2.2 tpmt? -77.64 -63.94 1.26 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 122.604 1.192 . . . . 0.0 109.376 174.422 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mp -99.82 -149.79 0.37 Allowed 'General case' 0 C--N 1.273 -2.724 0 N-CA-C 105.53 -2.026 . . . . 0.0 105.53 174.226 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -115.74 139.34 50.25 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 119.764 1.165 . . . . 0.0 112.25 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.5 m -101.4 157.06 34.39 Favored Pre-proline 0 C--N 1.303 -1.449 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.904 -177.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -64.98 164.18 25.78 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 121.713 1.609 . . . . 0.0 111.667 175.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -49.66 -44.57 47.82 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -176.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -80.83 15.43 1.78 Allowed 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -125.85 153.77 43.64 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.468 -0.77 . . . . 0.0 112.712 -172.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -94.83 -176.69 3.94 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 169.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.5 p -148.22 140.99 24.63 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 120.248 -0.581 . . . . 0.0 111.605 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -148.96 108.31 3.95 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 176.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 70.29 -85.35 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 125.366 1.466 . . . . 0.0 111.524 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -138.52 27.65 2.5 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.789 -174.916 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.57 157.23 44.01 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 176.404 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.639 ' SG ' HD11 ' A' ' 126' ' ' LEU . 7.6 m -112.69 140.79 47.17 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.008 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -116.63 145.77 43.17 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 118.801 0.728 . . . . 0.0 111.44 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -137.52 106.57 5.99 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.217 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.5 t -90.05 101.59 12.39 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.793 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.066 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.704 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 5.5 m -78.13 111.17 13.77 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.458 HE22 ' ND2' ' A' ' 62' ' ' ASN . 13.2 mm100 -79.01 14.73 1.3 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.77 0.828 . . . . 0.0 113.027 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.543 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 15.6 m -111.65 156.11 12.84 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 m -102.54 141.9 34.6 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -171.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -152.39 169.73 21.83 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 128.084 2.554 . . . . 0.0 106.842 -179.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 38.2 p -80.45 169.88 17.11 Favored 'General case' 0 C--O 1.253 1.278 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 169.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . 0.408 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 92.9 t90 -57.42 -49.04 77.49 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.743 0.306 . . . . 0.0 111.314 -176.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.05 -35.14 79.21 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.444 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -61.73 -47.77 83.74 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 120.519 0.199 . . . . 0.0 110.715 176.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.4 -35.87 92.63 Favored Glycine 0 CA--C 1.504 -0.631 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.252 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.99 -50.94 72.19 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 96.7 t -64.14 -32.99 59.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.504 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.19 -36.69 84.48 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.945 175.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 60.5 m -68.04 -39.78 83.01 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.43 -33.16 69.39 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 121.162 0.505 . . . . 0.0 109.842 176.38 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -60.03 -28.3 66.1 Favored Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 114.914 -1.039 . . . . 0.0 113.517 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -99.37 5.8 46.28 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 117.346 0.573 . . . . 0.0 110.302 177.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.5 49.94 41.02 Favored Glycine 0 N--CA 1.44 -1.046 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -174.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.28 177.38 9.05 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -118.88 165.59 13.87 Favored 'General case' 0 C--N 1.29 -2.014 0 C-N-CA 122.623 0.369 . . . . 0.0 110.587 -178.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.7 tp -77.54 132.02 38.15 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 18.1 tpt -30.38 121.93 0.19 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -114.39 98.64 7.04 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 40.8 mt -79.04 123.33 35.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -177.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 71.9 mm-40 -100.36 -20.63 15.75 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 120.055 -0.658 . . . . 0.0 112.45 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.458 ' OD2' ' HB2' ' A' ' 48' ' ' GLU . 21.3 t70 -159.72 169.69 23.14 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -174.715 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -73.34 -21.32 60.57 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 117.942 0.337 . . . . 0.0 110.781 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.458 ' HB2' ' OD2' ' A' ' 46' ' ' ASP . 0.5 OUTLIER -57.85 -34.41 69.7 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 123.847 0.859 . . . . 0.0 109.109 175.365 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.438 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 3.5 mm-40 -63.16 -55.04 28.54 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.296 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.631 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 79.6 mt -65.8 -24.81 67.0 Favored 'General case' 0 CA--C 1.496 -1.126 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -63.32 -44.93 93.53 Favored 'General case' 0 N--CA 1.402 -2.835 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -73.0 -25.28 60.92 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.654 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.662 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -63.52 -51.39 65.71 Favored 'General case' 0 C--O 1.184 -2.377 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.32 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.631 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 39.4 mt -51.96 -40.51 60.97 Favored 'General case' 0 C--N 1.311 -1.077 0 O-C-N 123.882 0.739 . . . . 0.0 111.562 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.34 -40.1 95.2 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.092 176.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.3 p -85.61 -9.69 56.93 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.468 0.651 . . . . 0.0 111.793 -179.126 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.662 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.8 mm -83.54 -52.4 13.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.083 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? 68.24 -69.86 0.14 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.209 1.004 . . . . 0.0 112.732 -178.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -59.12 -59.92 4.7 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 123.049 0.539 . . . . 0.0 111.895 -175.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt 75.03 -10.83 1.15 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.81 1.244 . . . . 0.0 112.772 -177.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -77.54 -21.95 51.83 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.682 0.277 . . . . 0.0 111.708 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.582 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 30.2 m-80 -78.84 -169.62 1.84 Allowed 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.521 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 15.9 m -140.96 122.97 15.53 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.592 -1.632 . . . . 0.0 106.592 178.113 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.582 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.8 m-85 -124.5 120.21 31.36 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -174.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -63.57 137.75 58.24 Favored 'General case' 0 C--N 1.311 -1.107 0 O-C-N 123.64 0.587 . . . . 0.0 111.451 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.67 175.13 2.86 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 168.766 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.583 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.53 44.55 2.25 Favored Glycine 0 C--O 1.216 -0.995 0 CA-C-N 118.792 0.724 . . . . 0.0 114.277 -174.788 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . 0.474 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 14.9 mt -113.51 123.81 50.9 Favored 'General case' 0 CA--C 1.486 -1.498 0 C-N-CA 124.154 0.981 . . . . 0.0 111.534 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -133.09 144.66 50.13 Favored 'General case' 0 C--N 1.295 -1.786 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.037 171.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.466 ' OH ' ' HG2' ' A' ' 75' ' ' MET . 82.6 t80 -85.15 128.86 34.83 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.5 p -115.7 128.88 56.22 Favored 'General case' 0 C--N 1.278 -2.52 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -173.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 43.1 mt -120.76 149.55 50.82 Favored Pre-proline 0 N--CA 1.435 -1.179 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 172.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -87.01 125.91 8.44 Favored 'Cis proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.539 -1.442 . . . . 0.0 112.517 -2.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 p30 171.58 -33.45 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.746 1.618 . . . . 0.0 110.008 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.466 ' HG2' ' OH ' ' A' ' 70' ' ' TYR . 83.2 mtp 70.71 22.62 4.83 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 123.819 0.7 . . . . 0.0 111.626 176.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -107.45 155.37 20.12 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.442 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -103.29 118.47 36.84 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -125.58 157.29 37.52 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.509 177.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.583 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.0 m95 -95.62 165.76 12.17 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.02 -178.128 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 pt -67.11 -17.03 22.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.489 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 26.7 p-10 -86.26 -15.98 39.05 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.11 8.49 36.09 Favored Glycine 0 C--N 1.317 -0.523 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.665 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.7 m -80.0 162.39 24.91 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 122.617 0.367 . . . . 0.0 111.304 175.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 27.1 m -99.93 140.57 33.96 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . 0.402 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 48.9 tp -68.21 133.21 48.49 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -89.26 91.07 8.62 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 167.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.2 m -70.99 -7.99 50.1 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.599 -177.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -77.75 -4.46 46.45 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.6 m -75.11 -52.95 17.4 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 118.646 -1.221 . . . . 0.0 110.939 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.5 mt -144.29 -178.44 5.97 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -176.455 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -69.41 111.53 5.35 Favored 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -177.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 9.4 mt -146.67 120.18 2.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.239 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 173.196 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 8.0 m -101.42 138.22 38.71 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 120.631 0.253 . . . . 0.0 110.6 -173.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -95.18 -15.29 45.21 Favored Glycine 0 N--CA 1.432 -1.624 0 N-CA-C 109.864 -1.294 . . . . 0.0 109.864 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -83.03 114.79 21.52 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 174.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.0 t -170.18 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.61 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 67.64 17.3 9.89 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -177.692 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -102.41 -171.33 1.94 Allowed 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -118.31 26.63 9.48 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 105.908 -1.886 . . . . 0.0 105.908 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 32.3 t -66.2 158.87 27.69 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 112.302 -2.226 . . . . 0.0 113.654 -172.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -135.1 154.56 51.63 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 124.831 1.253 . . . . 0.0 108.074 175.534 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -97.61 150.58 20.98 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -172.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -142.51 146.49 34.75 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 114.633 -1.167 . . . . 0.0 109.926 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.521 ' O ' ' HA ' ' A' ' 63' ' ' SER . 8.7 mm -77.44 126.71 38.13 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 C-N-CA 124.084 0.954 . . . . 0.0 108.585 177.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.2 t -154.36 96.47 1.92 Allowed 'General case' 0 N--CA 1.423 -1.781 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 102.72 -144.18 16.03 Favored Glycine 0 N--CA 1.426 -1.969 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -102.85 22.36 13.94 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 174.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -129.91 169.69 14.88 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 114.171 -1.377 . . . . 0.0 107.81 -174.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 20.9 t -111.86 141.01 28.62 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.13 0 N-CA-C 104.864 -2.272 . . . . 0.0 104.864 172.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.1 p -128.89 171.69 12.05 Favored 'General case' 0 C--N 1.277 -2.58 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 18.8 p90 -149.07 139.85 22.76 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 118.739 0.7 . . . . 0.0 112.257 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -147.27 -176.88 5.4 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.335 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.5 m -72.93 125.48 27.67 Favored 'General case' 0 C--N 1.296 -1.739 0 O-C-N 123.378 0.424 . . . . 0.0 110.328 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . 0.408 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 77.4 m -47.03 -23.27 0.44 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 126.803 2.041 . . . . 0.0 114.312 -177.692 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -83.03 -1.17 51.98 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.83 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.9 p -80.37 154.33 27.79 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 119.946 -0.701 . . . . 0.0 109.674 172.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -94.41 106.21 18.19 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -175.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -137.51 173.97 11.1 Favored 'General case' 0 C--O 1.204 -1.325 0 C-N-CA 123.179 0.592 . . . . 0.0 110.13 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.704 ' HB3' ' O ' ' A' ' 21' ' ' SER . 3.6 mpt_? -81.95 175.51 10.32 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 -177.763 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 18.9 p90 -149.77 165.81 31.33 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.642 1.11 . . . . 0.0 111.939 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 70.1 mt -124.61 124.88 69.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.356 0.598 . . . . 0.0 110.892 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 95.8 m -102.61 144.2 31.32 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.41 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.427 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 5.7 pt20 -127.48 139.55 52.73 Favored 'General case' 0 N--CA 1.42 -1.95 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 171.764 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.6 ttmm -110.64 118.25 35.7 Favored 'General case' 0 C--N 1.254 -3.567 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -69.79 118.34 12.52 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 175.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . 0.639 HD11 ' SG ' ' A' ' 17' ' ' CYS . 12.8 tp -72.45 -23.36 61.05 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 114.157 -1.383 . . . . 0.0 109.715 -172.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' TYR . . . . . 0.42 ' CE1' ' HG2' ' A' ' 3' ' ' LYS . 3.5 m-85 -73.36 27.54 0.06 Allowed 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 175.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . 0.413 ' H ' ' C ' ' A' ' 126' ' ' LEU . 36.6 t-80 -74.92 -22.15 58.78 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 168.298 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 69.01 157.44 0.15 Allowed 'General case' 0 C--N 1.348 0.536 0 C-N-CA 125.996 1.718 . . . . 0.0 114.36 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 m -90.18 99.51 12.52 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -76.08 160.02 30.19 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.322 -177.605 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 19.9 m 71.0 23.85 4.12 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.54 1.136 . . . . 0.0 111.985 176.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 62.76 -88.8 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.44 1.096 . . . . 0.0 111.933 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -147.86 157.23 43.43 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 -177.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 39.9 t -80.19 -33.63 14.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 125.64 -14.03 7.25 Favored Glycine 0 CA--C 1.504 -0.601 0 C-N-CA 120.222 -0.99 . . . . 0.0 112.149 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 99.8 m-85 63.92 -80.07 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.699 1.2 . . . . 0.0 112.876 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -109.07 -0.38 31.59 Favored Glycine 0 N--CA 1.438 -1.169 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.177 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 46.0 t60 . . . . . 0 C--N 1.308 -1.219 0 CA-C-O 118.317 -0.849 . . . . 0.0 108.864 178.848 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.7 t . . . . . 0 C--O 1.248 0.999 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.4 166.92 21.72 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -73.55 164.47 26.61 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 121.479 0.657 . . . . 0.0 112.148 -179.591 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.481 ' O ' ' HG2' ' A' ' 3' ' ' LYS . 4.4 mp -94.02 -166.22 1.46 Allowed 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -87.8 142.92 27.44 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 69.3 m -108.3 162.85 18.45 Favored Pre-proline 0 C--O 1.25 1.087 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.77 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.86 164.81 25.67 Favored 'Trans proline' 0 C--N 1.366 1.481 0 C-N-CA 122.493 2.129 . . . . 0.0 112.584 173.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -56.36 -21.51 25.15 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 125.481 1.512 . . . . 0.0 114.669 -175.478 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -85.17 -11.49 54.91 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 120.949 0.404 . . . . 0.0 110.411 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 37.4 m95 -113.34 158.93 19.96 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -165.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -99.38 175.96 5.68 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 169.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.7 p -139.9 132.39 28.6 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 118.8 0.727 . . . . 0.0 111.34 -179.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' HIS . . . . . 0.454 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 42.8 t-80 -149.57 124.09 9.71 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 122.188 -0.32 . . . . 0.0 111.041 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.501 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 3.0 mmp_? 66.71 -72.58 0.08 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.07 1.348 . . . . 0.0 113.22 175.561 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -158.98 21.37 0.2 Allowed 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 122.79 0.436 . . . . 0.0 110.511 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LYS . . . . . 0.51 ' HG2' ' NE2' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -145.01 148.1 33.36 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.518 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' CYS . . . . . 0.556 ' O ' ' HA ' ' A' ' 123' ' ' GLN . 8.9 m -95.87 146.58 24.45 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 175.472 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' PHE . . . . . 0.454 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 22.3 m-85 -117.9 143.12 46.61 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 118.624 0.647 . . . . 0.0 110.522 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -132.25 107.99 8.94 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 69.0 t -89.67 96.03 5.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.741 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 5.0 m -78.08 108.29 11.26 Favored 'General case' 0 N--CA 1.423 -1.786 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 14.8 mm100 -80.09 14.75 1.74 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.437 0.637 . . . . 0.0 112.201 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.47 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 6.0 m -103.13 150.06 6.92 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.881 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.4 m -106.01 141.55 37.2 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -172.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -154.16 174.39 14.8 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 127.906 2.483 . . . . 0.0 107.061 -176.009 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 60.0 p -84.55 163.96 19.04 Favored 'General case' 0 C--O 1.255 1.366 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 169.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.9 t90 -53.19 -46.6 69.07 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.139 0.495 . . . . 0.0 111.852 -177.509 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -64.07 -37.26 86.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.928 -176.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -68.33 -45.44 72.9 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.659 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.92 -34.84 89.08 Favored Glycine 0 CA--C 1.506 -0.502 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.496 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 tt -56.34 -50.99 69.9 Favored 'General case' 0 C--O 1.25 1.092 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 175.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.36 -38.95 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.958 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.47 -40.05 77.71 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 64.6 m -66.26 -39.68 89.63 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.57 -29.26 70.45 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 120.992 0.425 . . . . 0.0 110.838 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.94 -16.59 78.31 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.247 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -92.47 -11.16 35.39 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 177.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.2 31.12 29.14 Favored Glycine 0 N--CA 1.444 -0.825 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 -171.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -129.81 176.98 7.59 Favored 'General case' 0 N--CA 1.42 -1.929 0 CA-C-N 114.755 -0.723 . . . . 0.0 110.096 -174.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' THR . . . . . 0.425 ' HB ' HD11 ' A' ' 80' ' ' ILE . 2.9 p -115.3 157.85 23.21 Favored 'General case' 0 C--N 1.282 -2.329 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.891 178.614 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.9 tp -66.47 140.68 58.03 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 173.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.3 tpt -39.31 120.75 1.07 Allowed 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -171.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.1 tp -121.04 90.52 3.34 Favored 'General case' 0 N--CA 1.434 -1.265 0 N-CA-C 106.427 -1.694 . . . . 0.0 106.427 -175.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ILE . . . . . 0.422 HD11 HD13 ' A' ' 50' ' ' LEU . 44.4 mt -67.61 122.74 19.34 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.019 -171.639 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -92.9 -21.85 19.59 Favored 'General case' 0 CA--C 1.552 1.058 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.984 -176.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.595 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 28.3 t70 -173.08 177.64 2.69 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -171.09 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -78.65 -31.06 46.67 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.576 -0.702 . . . . 0.0 111.274 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -58.37 -30.23 66.62 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 124.052 0.941 . . . . 0.0 108.59 176.291 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLU . . . . . 0.595 ' HB2' ' O ' ' A' ' 46' ' ' ASP . 4.3 mm-40 -61.24 -56.27 22.52 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.429 174.636 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.589 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 79.5 mt -69.58 -28.47 66.0 Favored 'General case' 0 CA--C 1.48 -1.716 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -175.032 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.4 ptt180 -69.97 -34.19 73.05 Favored 'General case' 0 N--CA 1.421 -1.905 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.147 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -73.77 -28.28 61.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 175.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.642 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.0 mm? -61.47 -49.36 77.09 Favored 'General case' 0 C--O 1.182 -2.468 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 173.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.589 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 37.9 mt -55.35 -35.4 65.18 Favored 'General case' 0 C--N 1.313 -0.996 0 O-C-N 123.236 0.335 . . . . 0.0 111.351 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -68.12 -42.59 79.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.073 176.339 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.2 p -79.51 -24.52 42.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -178.239 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.642 HG12 ' O ' ' A' ' 53' ' ' LEU . 36.4 mm -65.84 -51.36 62.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 174.541 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 49.6 tptt 72.6 -65.67 0.34 Allowed 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.06 0.944 . . . . 0.0 113.472 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -65.06 -55.32 19.55 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 118.633 0.652 . . . . 0.0 112.429 -176.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.441 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 44.5 mtmt 69.44 21.34 6.9 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.429 0.692 . . . . 0.0 110.369 -177.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -120.17 19.7 12.17 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.272 0.558 . . . . 0.0 110.852 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.527 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 41.9 m-80 -124.47 -153.8 0.58 Allowed 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' SER . . . . . 0.587 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 5.6 t -149.8 126.97 11.31 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 175.715 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.527 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.1 m-85 -129.57 113.37 14.74 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -175.16 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -57.63 136.76 56.84 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 124.085 0.954 . . . . 0.0 112.29 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -120.68 176.71 3.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 170.629 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLY . . . . . 0.59 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -78.19 56.63 4.02 Favored Glycine 0 C--O 1.204 -1.775 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.814 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.7 mt -125.03 121.07 33.3 Favored 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 122.998 0.519 . . . . 0.0 111.718 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 30.0 ptt180 -128.3 135.42 49.59 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.084 176.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -81.33 113.5 19.48 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.4 p -103.4 124.43 48.68 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.848 -174.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.1 mt -119.89 148.5 46.67 Favored Pre-proline 0 C--N 1.313 -0.999 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.333 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -86.0 126.18 9.26 Favored 'Cis proline' 0 C--O 1.237 0.439 0 C-N-CA 123.651 -1.395 . . . . 0.0 110.426 -3.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.4 t70 176.64 -36.04 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -174.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.8 mpt? 64.03 8.62 4.08 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 125.441 1.497 . . . . 0.0 114.174 176.077 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -100.03 159.52 15.02 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 175.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -100.82 122.42 43.4 Favored 'General case' 0 C--N 1.288 -2.074 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -116.82 147.2 42.33 Favored 'General case' 0 C--N 1.291 -1.964 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.183 178.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' TRP . . . . . 0.59 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 16.1 m95 -91.0 178.14 6.09 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 123.951 0.782 . . . . 0.0 109.504 -177.621 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . 0.425 HD11 ' HB ' ' A' ' 40' ' ' THR . 48.6 pt -73.06 -12.46 15.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.028 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ASN . . . . . 0.489 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 31.5 p-10 -95.55 -0.91 51.52 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.802 0.81 . . . . 0.0 109.021 178.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.1 5.58 76.51 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 114.5 -1.227 . . . . 0.0 113.563 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.9 t -81.83 169.4 16.92 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -178.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.2 m -100.04 142.9 30.9 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 36.9 tp -54.57 138.87 39.88 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 124.63 1.172 . . . . 0.0 113.233 176.158 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ASN . . . . . 0.453 ' OD1' HG11 ' A' ' 89' ' ' VAL . 25.9 t-20 -93.57 86.52 5.22 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 170.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 p -73.08 3.83 5.05 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -77.57 -21.78 51.97 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.463 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.453 HG11 ' OD1' ' A' ' 86' ' ' ASN . 32.9 m -78.56 -55.24 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 C-N-CA 120.156 -0.617 . . . . 0.0 112.367 -178.463 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.4 mt -140.29 170.37 15.95 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -175.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.482 ' O ' HG12 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -72.97 123.19 23.0 Favored 'General case' 0 CA--C 1.5 -0.963 0 O-C-N 123.876 0.735 . . . . 0.0 112.632 -175.828 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ILE . . . . . 0.482 HG12 ' O ' ' A' ' 91' ' ' LYS . 2.4 mt -152.32 99.47 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 N-CA-C 104.733 -2.321 . . . . 0.0 104.733 174.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 5.3 m -66.8 136.69 55.84 Favored 'General case' 0 C--N 1.285 -2.21 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.553 -173.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -102.0 26.34 24.68 Favored Glycine 0 CA--C 1.479 -2.203 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -175.025 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -152.44 130.63 11.96 Favored 'General case' 0 N--CA 1.409 -2.515 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 174.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.4 t -169.93 -31.62 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.596 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 65.81 28.54 10.84 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.448 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -105.57 178.63 4.51 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.877 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -96.81 27.75 3.8 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.0 p -63.31 150.35 43.49 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 113.004 -1.907 . . . . 0.0 115.797 -171.93 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -134.03 147.53 50.97 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 113.444 -1.707 . . . . 0.0 106.688 173.686 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.48 151.56 19.27 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -172.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -146.71 147.37 30.9 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.849 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . 0.587 ' O ' ' HA ' ' A' ' 63' ' ' SER . 11.5 mm -76.95 131.06 35.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 107.397 -1.335 . . . . 0.0 107.397 177.569 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 27.9 t -106.68 -71.23 0.76 Allowed 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 175.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' GLY . . . . . 0.441 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . -124.98 -102.22 1.39 Allowed Glycine 0 N--CA 1.413 -2.893 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 178.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -98.64 2.47 47.29 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -125.51 162.74 24.22 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.034 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.8 t -99.37 136.82 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.419 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 174.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.3 p -125.39 166.47 16.51 Favored 'General case' 0 C--N 1.269 -2.917 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.8 p90 -138.85 134.15 32.94 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 118.927 0.785 . . . . 0.0 112.848 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -132.24 179.58 6.03 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.491 -1.231 . . . . 0.0 108.406 -176.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.4 m -78.31 129.22 34.77 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 174.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 76.6 m -48.21 -18.94 0.24 Allowed 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 126.591 1.956 . . . . 0.0 115.038 -176.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -86.37 -3.99 59.09 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 123.525 0.73 . . . . 0.0 110.559 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.0 p -77.43 149.59 35.1 Favored 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 119.965 -0.694 . . . . 0.0 111.069 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -86.39 93.8 9.21 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.989 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -128.35 174.45 9.3 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 114.804 -1.089 . . . . 0.0 108.523 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ARG . . . . . 0.741 ' HB3' ' O ' ' A' ' 21' ' ' SER . 2.5 mpt_? -93.37 -174.5 3.53 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 -177.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' TRP . . . . . 0.41 ' CH2' HG23 ' A' ' 23' ' ' VAL . 28.8 p90 -152.21 167.56 28.19 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.864 1.211 . . . . 0.0 111.95 -179.338 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 69.9 mt -125.59 129.85 72.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.451 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 75.0 m -110.03 150.98 27.75 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLN . . . . . 0.556 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.3 pt20 -128.25 140.64 51.78 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 171.839 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -117.27 115.16 24.74 Favored 'General case' 0 C--N 1.277 -2.556 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' GLU . . . . . 0.6 ' CD ' ' HA ' ' A' ' 128' ' ' HIS . 41.2 tt0 -74.95 120.69 20.82 Favored 'General case' 0 C--N 1.286 -2.156 0 CA-C-O 121.362 0.601 . . . . 0.0 111.803 -174.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -73.25 -39.31 65.54 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.075 179.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -152.41 130.3 11.73 Favored 'General case' 0 CA--C 1.482 -1.66 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.888 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' HIS . . . . . 0.6 ' HA ' ' CD ' ' A' ' 125' ' ' GLU . 77.8 t60 -65.71 142.37 58.03 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 124.073 0.858 . . . . 0.0 112.242 -174.166 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -45.6 114.57 0.78 Allowed 'General case' 0 C--O 1.239 0.503 0 O-C-N 124.896 1.372 . . . . 0.0 108.784 173.791 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 25.6 m -62.86 133.14 54.24 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.551 -170.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' LEU . . . . . 0.407 HD21 ' N ' ' A' ' 131' ' ' LEU . 2.1 mm? -83.36 158.07 22.3 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.337 -176.318 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.0 p -72.05 108.59 5.35 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-O 121.427 0.632 . . . . 0.0 112.222 -177.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . 0.286 20.6 m120 78.04 -84.33 0.02 OUTLIER 'General case' 0 CA--C 1.493 -1.249 0 C-N-CA 125.291 1.437 . . . . 0.0 114.189 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -129.02 169.26 14.91 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 120.056 -0.658 . . . . 0.0 112.28 -173.385 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' VAL . . . . . 0.515 ' O ' ' HA ' ' A' ' 139' ' ' HIS . 48.9 t -113.23 -38.05 2.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.978 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.624 177.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 80.65 -133.77 12.59 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.169 177.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -128.63 16.83 6.42 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 122.51 1.148 . . . . 0.0 109.125 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 168.94 -46.95 0.22 Allowed Glycine 0 CA--C 1.478 -2.222 0 N-CA-C 104.743 -3.343 . . . . 0.0 104.743 -177.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' HIS . . . . . 0.515 ' HA ' ' O ' ' A' ' 135' ' ' VAL . 5.2 t60 . . . . . 0 N--CA 1.419 -2.017 0 N-CA-C 103.158 -2.904 . . . . 0.0 103.158 168.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.0 mp . . . . . 0 C--O 1.222 -0.372 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -79.49 143.38 34.96 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -174.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.671 ' SG ' ' HD2' ' A' ' 7' ' ' PRO . 49.0 t -137.37 156.2 75.27 Favored Pre-proline 0 C--N 1.306 -1.293 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.671 ' HD2' ' SG ' ' A' ' 6' ' ' CYS . 81.7 Cg_exo -48.78 153.22 3.79 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 122.843 2.362 . . . . 0.0 112.814 176.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -59.95 -29.37 68.37 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -171.077 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -78.43 -10.84 59.86 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.295 0.569 . . . . 0.0 111.226 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.476 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 26.9 m95 -95.63 117.03 29.71 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.041 -173.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.421 ' H ' HD22 ' A' ' 11' ' ' LEU . 1.3 mm? -72.72 122.04 20.83 Favored 'General case' 0 CA--C 1.497 -1.066 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -176.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.0 p -92.7 128.52 38.58 Favored 'General case' 0 N--CA 1.41 -2.428 0 CA-C-O 122.355 1.074 . . . . 0.0 113.556 -174.014 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 25.5 t60 -138.41 154.78 48.9 Favored 'General case' 0 C--O 1.2 -1.531 0 C-N-CA 126.973 2.109 . . . . 0.0 105.839 -177.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -11.89 83.98 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.998 0 C-N-CA 125.78 1.632 . . . . 0.0 114.586 175.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.43 ' C ' ' HG3' ' A' ' 16' ' ' LYS . 18.9 m-20 60.74 23.53 13.42 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.801 1.641 . . . . 0.0 114.617 173.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.593 ' HE2' ' OE1' ' A' ' 49' ' ' GLU . 13.0 mtpp -148.86 142.58 25.56 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.859 ' SG ' ' HB3' ' A' ' 124' ' ' LYS . 19.4 p -123.9 139.28 54.11 Favored 'General case' 0 C--N 1.287 -2.116 0 O-C-N 121.511 -0.743 . . . . 0.0 109.807 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.448 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 17.5 m-85 -116.87 140.51 49.37 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -171.261 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -115.56 106.64 14.16 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.1 t -87.42 92.47 3.81 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.77 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.1 m -77.26 114.56 16.2 Favored 'General case' 0 N--CA 1.423 -1.804 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.354 -176.992 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.554 ' C ' ' HG2' ' A' ' 119' ' ' ARG . 61.1 mm-40 -83.86 13.92 4.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.755 0.822 . . . . 0.0 112.663 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.8 m -109.63 150.09 12.43 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 178.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.0 m -98.24 152.8 19.01 Favored 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -173.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.9 m-20 -154.43 -176.92 6.12 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 127.506 2.322 . . . . 0.0 106.687 178.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 61.3 p -91.81 168.34 11.52 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 168.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 92.0 t90 -58.35 -53.83 53.87 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.593 0.633 . . . . 0.0 112.289 -175.224 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.492 ' O ' HG23 ' A' ' 32' ' ' VAL . 42.9 mt-10 -64.93 -31.93 73.41 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.307 0.575 . . . . 0.0 110.416 -177.239 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -71.45 -42.15 68.56 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.124 -0.943 . . . . 0.0 110.594 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.57 -33.88 87.51 Favored Glycine 0 CA--C 1.501 -0.843 0 N-CA-C 110.859 -0.896 . . . . 0.0 110.859 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 tt -59.91 -46.86 88.01 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 176.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 28' ' ' GLU . 90.1 t -61.87 -36.68 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.274 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -61.26 -36.76 80.9 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.845 175.752 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.0 m -71.51 -40.07 70.38 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -55.98 -39.7 72.2 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -56.17 -34.41 62.54 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 114.943 -1.026 . . . . 0.0 114.434 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -89.76 -5.3 57.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.51 0.655 . . . . 0.0 111.507 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.06 51.91 5.98 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 107.753 -2.139 . . . . 0.0 107.753 -171.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.01 178.04 8.5 Favored 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.2 p -123.14 158.48 30.62 Favored 'General case' 0 C--N 1.281 -2.409 0 C-N-CA 122.765 0.426 . . . . 0.0 110.936 -177.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.1 tp -76.15 130.48 38.33 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 174.507 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.2 tpt -30.03 120.53 0.17 Allowed 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 117.264 2.32 . . . . 0.0 117.264 -169.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.444 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 3.1 mm? -109.1 110.95 22.32 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 124.704 1.201 . . . . 0.0 108.007 177.517 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.515 HD13 HD21 ' A' ' 50' ' ' LEU . 37.8 mt -98.68 132.84 43.1 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -175.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.488 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 56.0 tp60 -105.84 -44.27 4.67 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 120.868 0.365 . . . . 0.0 111.464 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -137.57 178.13 7.34 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -172.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -81.04 -19.42 43.88 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 122.049 -0.407 . . . . 0.0 110.362 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 51.9 mt-10 -57.91 -33.23 68.54 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.699 0.762 . . . . 0.0 109.788 173.495 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.593 ' OE1' ' HE2' ' A' ' 16' ' ' LYS . 10.2 mm-40 -64.89 -55.36 19.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.671 -1.15 . . . . 0.0 107.995 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.515 HD21 HD13 ' A' ' 44' ' ' ILE . 63.4 mt -68.96 -25.15 64.4 Favored 'General case' 0 CA--C 1.496 -1.13 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -176.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.509 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 34.7 ptt180 -68.93 -33.73 74.21 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.363 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -73.72 -28.21 61.59 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.669 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.4 mm? -63.75 -48.83 75.4 Favored 'General case' 0 C--O 1.176 -2.805 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.48 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 43.7 mt -54.76 -34.11 62.15 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -67.35 -46.74 72.51 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.953 0.406 . . . . 0.0 111.444 172.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.8 p -81.17 -20.88 40.27 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -174.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.669 HG12 ' O ' ' A' ' 53' ' ' LEU . 16.6 mm -56.24 -45.97 81.27 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 C-N-CA 123.817 0.847 . . . . 0.0 111.031 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? 69.86 -63.69 0.38 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.024 0.929 . . . . 0.0 112.798 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.87 -56.34 6.5 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -175.306 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.418 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 91.4 mttt 74.06 -38.57 0.4 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.175 0.99 . . . . 0.0 113.669 -176.486 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -82.3 28.85 0.44 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.879 0.847 . . . . 0.0 111.707 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -132.6 -173.99 3.33 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.026 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.607 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 13.3 m -137.63 133.09 33.93 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.055 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.483 ' CE2' HD12 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -131.47 118.62 20.44 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -175.556 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -59.99 135.95 57.87 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 123.357 0.663 . . . . 0.0 112.038 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.59 176.21 2.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 N-CA-C 106.6 -1.629 . . . . 0.0 106.6 169.527 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.558 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.28 40.44 1.73 Allowed Glycine 0 C--O 1.22 -0.763 0 CA-C-N 118.89 0.768 . . . . 0.0 114.59 -174.093 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.558 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 20.5 mt -101.93 115.51 30.7 Favored 'General case' 0 CA--C 1.488 -1.422 0 C-N-CA 123.191 0.596 . . . . 0.0 111.637 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 28.4 ptt180 -122.02 137.22 54.88 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.104 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -91.11 113.69 26.02 Favored 'General case' 0 C--N 1.287 -2.137 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.7 p . . . . . 0 C--N 1.301 -1.514 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -174.129 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 16.3 m120 . . . . . 0 CA--C 1.492 -1.278 0 CA-C-O 121.047 0.451 . . . . 0.0 110.052 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -88.92 125.72 35.07 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.371 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -118.9 158.84 24.91 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.121 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.558 ' CZ3' ' HG ' ' A' ' 68' ' ' LEU . 62.4 m95 -96.19 176.32 6.12 Favored 'General case' 0 C--N 1.277 -2.572 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.185 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.4 pt -73.36 -23.34 19.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 CA-C-O 121.01 0.433 . . . . 0.0 111.362 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.416 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 29.6 p-10 -83.3 -16.32 46.68 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.3 8.49 35.64 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.435 -0.802 . . . . 0.0 113.081 175.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.8 m -75.65 170.52 16.01 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 175.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 20.7 m -102.54 139.68 37.82 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.533 HD13 HD21 ' A' ' 68' ' ' LEU . 42.0 tp -62.98 142.36 58.39 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 176.741 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -95.7 86.8 4.5 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.6 p -71.09 -8.23 52.02 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -176.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -77.94 -14.12 59.64 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.424 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 27.7 m -75.76 -49.66 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.828 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.0 mt -147.69 -179.01 6.57 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 -173.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 99.87 1.74 Allowed 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.041 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.48 HD12 HD11 ' A' ' 85' ' ' LEU . 8.0 mt -140.51 96.67 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 172.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.3 m -62.24 124.67 21.48 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.884 -178.024 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -85.69 -41.49 7.24 Favored Glycine 0 N--CA 1.41 -3.059 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -94.29 88.37 5.54 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-O 121.82 0.819 . . . . 0.0 110.971 178.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.8 t -126.39 -32.43 2.68 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.536 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 60.83 36.99 18.91 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.303 0.641 . . . . 0.0 111.383 176.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -116.99 177.82 4.57 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -81.58 27.69 0.43 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 126.167 1.787 . . . . 0.0 109.372 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.411 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 13.9 m -72.85 142.62 47.97 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -170.033 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 61.6 m -133.06 146.28 51.54 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 103.944 -2.613 . . . . 0.0 103.944 166.075 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -99.81 153.14 19.37 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -172.193 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.29 148.43 36.33 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.61 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.607 ' O ' ' HA ' ' A' ' 63' ' ' SER . 11.0 mm -78.13 128.4 38.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.483 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 175.02 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.1 t -140.42 90.17 2.34 Favored 'General case' 0 N--CA 1.408 -2.529 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.418 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . 89.0 -126.65 8.3 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.25 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -101.86 8.55 41.23 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 176.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -119.13 167.21 12.02 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.814 -175.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 14.2 t -115.75 134.24 59.63 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 N-CA-C 104.682 -2.34 . . . . 0.0 104.682 173.265 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 69.7 p -124.97 170.07 11.48 Favored 'General case' 0 C--N 1.267 -2.988 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.411 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 25.4 p90 -148.46 142.04 25.45 Favored 'General case' 0 C--N 1.298 -1.666 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.421 -178.781 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -154.69 178.69 9.83 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.815 -176.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.3 m -54.07 124.53 15.9 Favored 'General case' 0 N--CA 1.443 -0.817 0 O-C-N 124.132 0.895 . . . . 0.0 108.992 176.486 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 8.4 m -53.57 -22.88 9.27 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.491 1.117 . . . . 0.0 112.635 -174.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -80.43 -2.06 44.15 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 24.9 p -74.47 136.58 42.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 119.236 0.925 . . . . 0.0 112.608 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.79 101.42 0.26 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.328 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' ASN . . . . . 0.531 ' OD1' ' HB2' ' A' ' 63' ' ' SER . 47.3 m-80 -142.58 158.98 43.1 Favored 'General case' 0 CA--C 1.485 -1.539 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.209 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.77 ' HB3' ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.57 178.68 6.49 Favored 'General case' 0 C--N 1.292 -1.925 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.093 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 18.4 p90 -152.36 167.14 29.65 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 118.733 -1.187 . . . . 0.0 112.36 -174.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.507 HD13 HD12 ' A' ' 53' ' ' LEU . 82.6 mt -125.29 118.28 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 CA-C-O 121.625 0.726 . . . . 0.0 110.712 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 90.7 m -97.02 140.87 30.89 Favored 'General case' 0 C--N 1.287 -2.135 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.758 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 123' ' ' GLN . 5.0 pt20 -120.12 137.86 53.91 Favored 'General case' 0 N--CA 1.415 -2.213 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 173.553 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.859 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 22.8 ttmm -110.95 110.91 21.69 Favored 'General case' 0 C--N 1.258 -3.374 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 171.113 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -83.54 124.0 30.31 Favored 'General case' 0 N--CA 1.406 -2.63 0 C-N-CA 119.621 -0.832 . . . . 0.0 108.767 -175.333 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.8 mm? . . . . . 0 C--N 1.316 -0.852 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.255 -177.117 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.442 HD13 ' HB3' ' A' ' 126' ' ' LEU . 4.7 mp . . . . . 0 N--CA 1.44 -0.936 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -94.38 135.05 36.24 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.577 -176.557 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.494 ' HB3' HD11 ' A' ' 126' ' ' LEU . 8.8 p -128.58 166.41 24.76 Favored Pre-proline 0 C--N 1.296 -1.738 0 C-N-CA 124.089 0.956 . . . . 0.0 108.501 177.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -61.42 156.91 43.66 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 121.641 1.561 . . . . 0.0 113.155 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -42.64 -48.64 5.51 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 116.299 1.963 . . . . 0.0 116.299 -175.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -83.76 7.15 18.68 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -172.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.521 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 60.1 m95 -104.4 121.45 43.42 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 121.232 0.539 . . . . 0.0 110.711 -177.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.534 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 4.8 mp -75.92 106.51 7.54 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 124.843 1.257 . . . . 0.0 111.063 -176.349 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.1 p -74.66 114.44 13.08 Favored 'General case' 0 C--N 1.276 -2.625 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.794 -176.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -138.93 125.72 20.9 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 123.999 0.919 . . . . 0.0 109.413 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 57.93 -88.61 0.02 OUTLIER 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -178.623 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -144.69 25.31 1.48 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.499 0.666 . . . . 0.0 110.112 -177.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.36 151.7 36.96 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 178.703 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.636 ' SG ' HD21 ' A' ' 126' ' ' LEU . 80.8 m -116.34 140.36 49.42 Favored 'General case' 0 C--N 1.275 -2.631 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.057 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -110.82 141.67 43.86 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.206 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -119.24 108.17 14.31 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 173.757 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.0 t -89.18 95.05 5.13 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.69 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.8 m -77.97 115.19 17.52 Favored 'General case' 0 N--CA 1.417 -2.085 0 CA-C-N 115.328 -0.851 . . . . 0.0 108.725 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -87.82 13.75 10.08 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.956 0.902 . . . . 0.0 111.255 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.8 m -107.65 156.48 8.12 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 37.7 m -91.77 156.74 17.33 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -173.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.1 m-20 -170.88 170.75 6.28 Favored 'General case' 0 CA--C 1.502 -0.876 0 C-N-CA 127.414 2.286 . . . . 0.0 107.912 175.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.5 p -85.02 166.02 17.06 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 172.051 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.534 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 88.9 t90 -56.48 -53.26 59.54 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -174.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.461 ' O ' HG23 ' A' ' 32' ' ' VAL . 37.9 mt-10 -63.92 -32.29 73.77 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.942 0.877 . . . . 0.0 110.556 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -73.91 -44.28 55.68 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.46 -1.245 . . . . 0.0 110.412 -175.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.12 -34.63 90.49 Favored Glycine 0 C--O 1.221 -0.682 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 174.504 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 tt -58.86 -51.17 71.14 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 28' ' ' GLU . 87.6 t -59.3 -38.21 73.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.502 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.89 -36.64 84.59 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.98 -0.555 . . . . 0.0 112.103 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 81.3 m -66.34 -43.47 86.02 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -57.23 -29.88 64.13 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.577 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -56.92 -34.91 66.33 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.933 179.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -101.44 11.57 38.89 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.78 14.07 82.93 Favored Glycine 0 C--O 1.245 0.794 0 CA-C-O 121.625 0.57 . . . . 0.0 111.763 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -104.69 166.16 10.58 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -175.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.429 ' HB ' HD11 ' A' ' 80' ' ' ILE . 3.2 p -110.01 160.57 16.32 Favored 'General case' 0 C--N 1.28 -2.441 0 O-C-N 122.175 -0.328 . . . . 0.0 110.626 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -75.52 124.69 27.61 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.3 tpt -24.72 120.09 0.05 Allowed 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 -170.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -110.55 105.45 14.39 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 124.845 1.258 . . . . 0.0 107.62 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.517 HD13 HD11 ' A' ' 50' ' ' LEU . 34.2 mt -86.22 105.81 15.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -176.162 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -90.27 -22.69 21.47 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.731 -176.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.545 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 15.9 t70 -149.64 163.9 36.63 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -170.614 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -35.22 80.32 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 176.253 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -60.56 -27.83 67.97 Favored 'General case' 0 CA--C 1.499 -0.983 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.545 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 13.3 mm-40 -57.54 -55.79 30.26 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.652 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 61.6 mt -71.88 -25.78 62.07 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -177.508 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -62.88 -38.01 89.2 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -68.06 -37.0 80.79 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.839 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.692 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.5 mm? -62.48 -53.17 58.81 Favored 'General case' 0 C--O 1.206 -1.193 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.652 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 60.3 mt -56.49 -34.59 67.1 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -177.14 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -73.56 -41.91 62.32 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 176.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.3 p -81.4 -34.98 31.26 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.692 HG12 ' O ' ' A' ' 53' ' ' LEU . 51.0 mm -57.12 -45.73 84.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 CA-C-O 121.244 0.545 . . . . 0.0 109.655 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 52.0 tptt 68.96 -56.79 0.53 Allowed 'General case' 0 C--O 1.24 0.588 0 C-N-CA 124.895 1.278 . . . . 0.0 112.858 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -62.26 -52.18 64.75 Favored 'General case' 0 C--O 1.207 -1.156 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.61 ' H ' HG22 ' A' ' 57' ' ' ILE . 97.6 mttt 73.86 -47.98 0.66 Allowed 'General case' 0 C--O 1.205 -1.27 0 C-N-CA 124.98 1.312 . . . . 0.0 112.712 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -70.21 27.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.168 1.387 . . . . 0.0 114.058 -174.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.564 ' O ' ' HA ' ' A' ' 105' ' ' SER . 77.6 m-20 -115.29 -171.18 1.91 Allowed 'General case' 0 C--N 1.286 -2.186 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 176.345 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.657 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 14.0 m -144.82 119.3 9.67 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.532 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.5 m-85 -124.33 123.47 40.27 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -176.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.533 ' CE2' ' HB2' ' A' ' 118' ' ' ASN . 78.0 m95 -62.17 138.86 58.47 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 123.182 0.593 . . . . 0.0 110.616 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -118.45 174.67 4.11 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 169.371 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.619 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.41 47.52 2.39 Favored Glycine 0 C--O 1.21 -1.386 0 CA-C-N 118.728 0.695 . . . . 0.0 114.817 -173.805 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.494 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 17.3 mt -113.4 120.01 39.61 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 123.451 0.701 . . . . 0.0 111.901 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -126.4 140.38 52.53 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.291 176.565 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -91.06 124.5 35.34 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.5 p . . . . . 0 C--N 1.3 -1.572 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -175.397 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.9 m120 . . . . . 0 C--O 1.258 1.509 0 CA-C-O 121.097 0.475 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 66.8 m95 -97.41 134.41 40.71 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -126.79 151.97 47.55 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.683 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.619 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 37.0 m95 -93.63 169.93 9.96 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.429 HD11 ' HB ' ' A' ' 40' ' ' THR . 38.6 pt -69.38 -20.42 24.13 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -177.046 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.4 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 31.3 p-10 -85.05 -14.14 48.24 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.655 0.741 . . . . 0.0 109.286 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.98 8.41 36.55 Favored Glycine 0 N--CA 1.443 -0.894 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.363 176.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.8 m -74.97 163.42 27.64 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.032 0.444 . . . . 0.0 111.692 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 19.9 m -98.96 140.4 33.16 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 176.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.574 HD11 HD12 ' A' ' 92' ' ' ILE . 43.5 tp -54.64 143.86 23.57 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -100.87 95.73 6.82 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 170.149 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.0 m -71.39 -11.28 60.81 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.123 0.487 . . . . 0.0 111.814 -175.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -78.14 -12.49 60.0 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -176.325 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 29.2 m -75.3 -54.2 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 C-N-CA 119.079 -1.048 . . . . 0.0 112.473 -177.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.5 mt -152.03 -178.29 6.68 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -177.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -68.33 111.88 4.87 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -176.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.574 HD12 HD11 ' A' ' 85' ' ' LEU . 9.7 mt -145.97 105.44 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 174.314 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.0 m -61.06 128.99 39.16 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 123.021 0.529 . . . . 0.0 109.899 -179.169 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -84.33 -53.33 3.3 Favored Glycine 0 N--CA 1.418 -2.516 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 -176.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -93.23 82.56 4.53 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-O 122.767 1.27 . . . . 0.0 110.536 176.354 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.6 t -100.69 -24.01 14.51 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.587 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 63.46 17.63 10.47 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.609 0.764 . . . . 0.0 112.218 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -111.32 -178.68 3.51 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -86.67 26.93 1.03 Allowed 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 126.654 1.982 . . . . 0.0 109.798 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 m -72.1 150.72 43.63 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 116.619 2.081 . . . . 0.0 116.619 -170.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -143.45 148.78 36.63 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 166.562 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -98.09 153.81 18.17 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -169.072 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.25 150.2 38.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.376 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.657 ' O ' ' HA ' ' A' ' 63' ' ' SER . 17.5 mm -77.82 112.11 15.41 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.532 0 N-CA-C 106.627 -1.619 . . . . 0.0 106.627 173.205 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.564 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 8.8 t -134.04 100.6 4.77 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 98.62 -134.43 11.69 Favored Glycine 0 C--N 1.276 -2.79 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -100.15 0.98 41.63 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -128.77 -176.66 3.91 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.315 -172.162 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.2 t -105.88 135.41 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.548 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 71.2 p -131.32 175.08 9.43 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 106.406 -1.701 . . . . 0.0 106.406 176.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -146.5 156.91 43.61 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 119.94 1.245 . . . . 0.0 113.307 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -161.3 -176.38 5.37 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.362 1.065 . . . . 0.0 109.67 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 17.5 t -68.66 128.38 36.42 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 176.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.534 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 79.5 m -50.62 -12.93 0.11 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 126.045 1.738 . . . . 0.0 115.202 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -100.97 3.66 41.81 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.279 -168.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.5 p -85.81 172.65 10.62 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 121.593 0.711 . . . . 0.0 111.522 177.212 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.54 123.07 26.68 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.227 175.974 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' ASN . . . . . 0.533 ' HB2' ' CE2' ' A' ' 65' ' ' TRP . 74.5 m-20 -158.88 172.73 17.68 Favored 'General case' 0 CA--C 1.488 -1.439 0 C-N-CA 125.092 1.357 . . . . 0.0 107.421 172.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.69 ' HB3' ' O ' ' A' ' 21' ' ' SER . 2.2 mpt_? -100.96 -169.92 1.77 Allowed 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 178.631 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 16.0 p90 -154.41 160.99 41.95 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.663 1.574 . . . . 0.0 112.573 -177.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 75.3 mt -120.83 125.54 74.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.941 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 72.2 m -106.17 146.9 29.66 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.109 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -123.77 133.91 53.75 Favored 'General case' 0 N--CA 1.425 -1.718 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 173.453 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.7 tttm -109.81 109.21 19.8 Favored 'General case' 0 C--N 1.272 -2.763 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.35 124.23 28.68 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 121.353 0.597 . . . . 0.0 110.69 -172.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.636 HD21 ' SG ' ' A' ' 17' ' ' CYS . 2.9 mm? . . . . . 0 C--N 1.312 -1.05 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.091 -178.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.65 HD13 ' HB3' ' A' ' 126' ' ' LEU . 4.8 mp . . . . . 0 CA--C 1.545 0.764 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -87.37 147.44 25.47 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -177.576 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.556 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 65.0 m -113.45 164.36 15.97 Favored Pre-proline 0 C--N 1.301 -1.508 0 CA-C-N 113.759 -1.564 . . . . 0.0 110.591 -177.1 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.29 164.06 18.59 Favored 'Trans proline' 0 C--N 1.367 1.501 0 C-N-CA 122.2 1.934 . . . . 0.0 112.377 175.469 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -53.98 -35.66 62.06 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -174.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.55 4.76 50.31 Favored 'General case' 0 C--N 1.317 -0.809 0 O-C-N 121.986 -0.446 . . . . 0.0 111.418 -175.049 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 24.9 m95 -112.89 145.93 39.85 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 120.821 0.343 . . . . 0.0 110.973 -174.296 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.1 mm? -100.62 178.83 4.6 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 105.271 -2.122 . . . . 0.0 105.271 173.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.556 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 56.1 p -155.89 148.81 24.25 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 119.525 1.057 . . . . 0.0 113.334 179.381 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 29.2 t-80 -154.37 135.96 14.32 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 67.83 -70.87 0.11 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.625 1.17 . . . . 0.0 113.828 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . 0.454 ' C ' ' HD3' ' A' ' 16' ' ' LYS . 9.4 p-10 -167.31 24.69 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.839 -174.409 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.454 ' HD3' ' C ' ' A' ' 15' ' ' ASP . 3.9 mppt? -144.5 143.8 31.03 Favored 'General case' 0 CA--C 1.511 -0.547 0 C-N-CA 122.834 0.454 . . . . 0.0 110.358 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.563 ' O ' ' HA ' ' A' ' 123' ' ' GLN . 15.2 m -97.1 151.36 19.84 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 174.306 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -130.77 134.04 46.52 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 118.486 0.585 . . . . 0.0 110.046 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -119.76 108.94 15.02 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.6 t -83.87 93.79 3.29 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.778 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.5 m -77.67 110.8 12.81 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.243 -177.538 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -83.44 14.35 3.75 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.889 0.876 . . . . 0.0 112.962 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.59 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 6.7 m -107.14 153.55 8.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.7 m -108.83 143.96 37.32 Favored 'General case' 0 C--N 1.3 -1.543 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -173.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -154.3 172.98 16.8 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 126.476 1.91 . . . . 0.0 108.994 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.4 p -77.86 166.68 22.61 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 171.224 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 t90 -56.56 -50.96 70.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.337 0.589 . . . . 0.0 111.477 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.532 ' H ' ' CD ' ' A' ' 28' ' ' GLU . 0.1 OUTLIER -65.92 -35.95 82.04 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.993 -176.615 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -66.3 -45.06 81.69 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.832 -179.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.65 -32.24 82.76 Favored Glycine 0 N--CA 1.465 0.594 0 C-N-CA 121.39 -0.434 . . . . 0.0 112.388 176.415 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tt -61.28 -51.52 68.56 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 58.8 t -61.92 -32.08 53.1 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.331 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.547 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 0.9 OUTLIER -61.65 -45.3 94.64 Favored 'General case' 0 CA--C 1.501 -0.935 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.853 174.835 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 60.5 m -64.25 -41.92 96.74 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -56.69 -38.05 71.74 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 123.793 0.683 . . . . 0.0 109.637 176.435 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.26 -23.15 61.8 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 114.913 -1.039 . . . . 0.0 114.036 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.547 ' HD2' ' O ' ' A' ' 33' ' ' ASP . 2.1 mptp? -97.27 2.73 51.14 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 117.915 0.857 . . . . 0.0 110.711 177.284 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.93 50.01 25.68 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 108.499 -1.84 . . . . 0.0 108.499 -173.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.572 ' HB1' ' O ' ' A' ' 123' ' ' GLN . . . -147.82 176.77 9.87 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.402 ' HB ' HD11 ' A' ' 80' ' ' ILE . 1.6 p -116.14 164.86 13.86 Favored 'General case' 0 C--N 1.292 -1.917 0 C-N-CA 122.798 0.439 . . . . 0.0 110.684 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.0 tp -80.96 127.95 33.14 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 105.936 -1.876 . . . . 0.0 105.936 174.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.3 tpt -28.73 122.4 0.12 Allowed 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 -169.562 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -114.68 108.86 17.36 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.345 1.458 . . . . 0.0 107.387 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.499 HD13 HD11 ' A' ' 50' ' ' LEU . 52.9 mt -88.88 110.57 21.54 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.152 0.501 . . . . 0.0 111.512 -173.244 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -79.97 -32.32 39.85 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.794 -177.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -158.59 169.33 24.66 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -34.34 76.54 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 123.496 0.718 . . . . 0.0 109.62 178.507 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 12.0 pt-20 -58.38 -27.31 64.12 Favored 'General case' 0 C--O 1.243 0.723 0 C-N-CA 122.886 0.474 . . . . 0.0 111.363 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -66.92 -54.35 22.95 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 37.7 mt -66.65 -26.95 67.3 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.499 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 20.3 ptt180 -68.58 -32.02 71.64 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 119.331 -0.948 . . . . 0.0 109.363 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -74.26 -27.99 61.0 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.693 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -65.17 -48.15 74.48 Favored 'General case' 0 C--O 1.193 -1.906 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 46.3 mt -57.78 -33.43 68.52 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 123.412 0.445 . . . . 0.0 111.464 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.92 -41.76 97.57 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.551 175.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.3 p -88.27 -24.64 23.15 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -176.045 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.693 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.8 mm -56.33 -47.77 80.76 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 C-N-CA 123.603 0.761 . . . . 0.0 111.081 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 52.5 tptt 67.98 -69.65 0.14 Allowed 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.916 1.286 . . . . 0.0 113.696 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -65.55 -34.56 78.53 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.585 ' H ' HG22 ' A' ' 57' ' ' ILE . 49.4 mttp 72.98 -57.19 0.64 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.755 1.222 . . . . 0.0 112.354 177.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -68.74 6.55 0.83 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.168 1.387 . . . . 0.0 114.407 -170.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.593 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 51.2 m-80 -82.63 -168.49 2.04 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 173.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 8.3 m -140.22 114.51 9.19 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.134 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.593 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 4.9 m-85 -121.55 120.11 33.9 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.267 -177.107 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.42 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 55.0 m95 -62.81 137.59 58.31 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 123.067 0.547 . . . . 0.0 111.071 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.88 177.33 2.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 167.636 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.693 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.28 54.07 3.55 Favored Glycine 0 C--O 1.199 -2.07 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.382 -176.511 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 35.1 mt -126.52 118.28 24.58 Favored 'General case' 0 CA--C 1.489 -1.383 0 C-N-CA 123.55 0.74 . . . . 0.0 111.689 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -133.73 141.49 47.55 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 173.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.449 ' HE1' ' O ' ' A' ' 94' ' ' GLY . 59.1 t80 -86.14 112.59 21.45 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 104.26 -2.496 . . . . 0.0 104.26 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.274 -2.681 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -173.574 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 . . . . . 0 CA--C 1.507 -0.689 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -95.27 111.46 23.31 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.313 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -114.38 147.65 38.86 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.102 -178.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.693 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 49.0 m95 -93.4 169.21 10.54 Favored 'General case' 0 N--CA 1.429 -1.522 0 CA-C-N 114.772 -1.103 . . . . 0.0 108.55 178.282 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.402 HD11 ' HB ' ' A' ' 40' ' ' THR . 40.8 pt -71.83 -13.9 17.11 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.909 -178.838 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.541 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 33.7 p-10 -89.84 -11.0 43.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.485 0.659 . . . . 0.0 109.402 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.12 1.05 44.84 Favored Glycine 0 CA--C 1.499 -0.918 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.155 174.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 57.2 m -80.04 165.77 22.21 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 122.834 0.454 . . . . 0.0 111.939 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.3 m -105.05 141.87 35.85 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.322 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.447 HD11 HD12 ' A' ' 92' ' ' ILE . 39.0 tp -56.91 140.21 49.21 Favored 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 124.98 1.312 . . . . 0.0 113.845 178.132 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -95.2 98.39 10.59 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 166.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.4 p -70.61 -8.68 53.48 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -175.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -78.44 -6.0 54.06 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 27.5 m -74.73 -48.22 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 C-N-CA 119.045 -1.062 . . . . 0.0 111.266 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.1 mt -153.78 177.56 10.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -177.717 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.89 109.51 2.11 Favored 'General case' 0 CA--C 1.499 -1.001 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.447 HD12 HD11 ' A' ' 85' ' ' LEU . 9.4 mt -146.66 106.3 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 171.072 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.7 m -63.97 122.26 16.07 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.449 ' O ' ' HE1' ' A' ' 70' ' ' TYR . . . -89.54 -19.53 48.43 Favored Glycine 0 N--CA 1.419 -2.445 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -174.442 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -122.3 104.84 9.7 Favored 'General case' 0 N--CA 1.422 -1.825 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 175.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.489 HG23 ' H ' ' A' ' 98' ' ' ASN . 12.3 t -141.36 -26.05 0.7 Allowed 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.4 -173.578 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 62.67 29.41 16.85 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.489 ' H ' HG23 ' A' ' 96' ' ' THR . 40.6 m-80 -122.53 143.84 49.47 Favored 'General case' 0 C--O 1.205 -1.282 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 175.683 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -82.55 27.32 0.52 Allowed 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 125.049 1.34 . . . . 0.0 110.622 -172.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 32.8 t -74.09 158.29 34.51 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 125.782 1.633 . . . . 0.0 112.276 -173.572 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 88.5 m -117.31 143.88 45.46 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -89.45 143.12 27.07 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-O 121.427 0.632 . . . . 0.0 112.154 -175.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -141.07 151.74 44.26 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.556 -178.499 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.439 HD11 HD22 ' A' ' 50' ' ' LEU . 13.9 mm -77.48 121.77 30.74 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 175.243 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 8.8 t -145.32 97.31 2.98 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.71 -119.83 6.66 Favored Glycine 0 C--N 1.283 -2.374 0 CA-C-N 114.317 -1.31 . . . . 0.0 110.186 179.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.506 ' OD2' ' HE2' ' A' ' 108' ' ' LYS . 6.5 p-10 -115.19 8.52 15.59 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 123.323 0.649 . . . . 0.0 109.249 177.708 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.506 ' HE2' ' OD2' ' A' ' 107' ' ' ASP . 74.4 mmtt -134.92 174.69 10.32 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.486 -176.266 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.3 t -101.39 130.65 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.031 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 175.83 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 59.1 p -131.6 141.83 49.75 Favored 'General case' 0 C--N 1.272 -2.788 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.437 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 6.8 p90 -99.79 133.1 44.64 Favored 'General case' 0 C--N 1.287 -2.115 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -177.78 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -121.1 165.75 14.89 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 114.427 -1.261 . . . . 0.0 107.622 -174.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 38.2 m -64.74 130.59 44.11 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 8.5 m -59.98 -19.64 53.35 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.417 0.627 . . . . 0.0 111.434 -175.471 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -93.38 4.39 54.04 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.255 1.022 . . . . 0.0 112.574 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.4 p -73.54 -7.95 53.96 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 13.8 t70 62.64 87.48 0.1 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.628 1.171 . . . . 0.0 110.392 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -127.81 175.07 8.61 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -177.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.778 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.2 mpt_? -83.43 -174.7 5.44 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 -177.739 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.447 ' CH2' HG23 ' A' ' 23' ' ' VAL . 26.9 p90 -156.58 172.72 18.08 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.659 1.118 . . . . 0.0 112.132 -177.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 85.5 mt -126.44 122.59 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-O 121.417 0.627 . . . . 0.0 110.128 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 74.3 m -100.12 143.72 29.99 Favored 'General case' 0 C--N 1.29 -2.022 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.572 ' O ' ' HB1' ' A' ' 39' ' ' ALA . 6.3 pt20 -121.54 154.06 37.18 Favored 'General case' 0 N--CA 1.417 -2.089 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 173.698 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.404 ' HB3' ' HB2' ' A' ' 17' ' ' CYS . 21.6 ttmm -132.33 110.47 10.6 Favored 'General case' 0 C--N 1.268 -2.95 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 176.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.9 118.33 18.58 Favored 'General case' 0 C--N 1.282 -2.338 0 CA-C-O 121.648 0.737 . . . . 0.0 111.96 -177.304 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.65 ' HB3' HD13 ' A' ' 4' ' ' LEU . 2.6 mm? . . . . . 0 N--CA 1.435 -1.201 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.414 176.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.434 HD13 ' HG ' ' A' ' 126' ' ' LEU . 2.2 mp . . . . . 0 CA--C 1.547 0.847 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -99.21 140.14 33.82 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.168 -1.013 . . . . 0.0 111.8 178.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 65.7 m -101.93 161.91 22.0 Favored Pre-proline 0 C--N 1.309 -1.179 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.665 -176.03 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.602 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 31.8 Cg_exo -61.81 156.37 48.93 Favored 'Trans proline' 0 CA--C 1.555 1.562 0 C-N-CA 121.612 1.541 . . . . 0.0 109.854 173.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -51.71 -33.66 35.34 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 116.528 2.048 . . . . 0.0 116.528 -169.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -97.71 5.77 48.83 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 121.714 -0.616 . . . . 0.0 111.887 -174.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.602 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 17.3 m95 -101.14 135.95 41.78 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 120.647 0.261 . . . . 0.0 111.302 -174.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.409 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.5 mm? -93.83 130.4 39.88 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.547 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 25.8 p -96.43 130.25 43.61 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -175.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -151.09 119.44 6.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.954 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.407 ' HD3' ' OE1' ' A' ' 48' ' ' GLU . 21.8 mtm180 54.68 46.36 24.85 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 125.849 1.659 . . . . 0.0 112.796 175.315 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 69.73 36.27 2.15 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.136 0.974 . . . . 0.0 111.026 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' A' ' 12' ' ' SER . 10.2 mptt -141.72 159.83 41.42 Favored 'General case' 0 CA--C 1.499 -1.001 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 174.236 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.709 ' SG ' HD13 ' A' ' 126' ' ' LEU . 4.6 m -129.44 132.26 46.93 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 177.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 19.3 m-85 -111.41 137.28 49.4 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 117.911 0.323 . . . . 0.0 110.832 -177.157 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.452 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 42.3 t-80 -121.11 108.33 13.67 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.7 t -88.22 93.59 4.31 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 176.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.73 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 4.1 m -77.76 113.56 15.75 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.053 -177.079 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.473 ' C ' ' HG2' ' A' ' 119' ' ' ARG . 84.8 mm-40 -85.0 14.36 5.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.803 0.841 . . . . 0.0 111.962 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 13.9 m -105.68 157.21 6.38 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 179.269 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 m -110.4 147.29 34.3 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -169.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.446 ' HB3' ' HB3' ' A' ' 29' ' ' GLU . 35.2 m-20 -159.73 -178.07 6.81 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 126.491 1.916 . . . . 0.0 108.7 -178.555 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 71.2 p -86.5 170.38 11.98 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 171.454 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 87.9 t90 -59.91 -51.58 69.09 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.016 0.436 . . . . 0.0 110.43 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.483 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 49.9 mt-10 -67.47 -31.23 71.24 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.726 -177.291 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLU . . . . . 0.446 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 7.8 tp10 -67.21 -49.55 64.13 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.88 -31.92 80.1 Favored Glycine 0 C--N 1.344 0.975 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.782 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.483 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 3.1 tm? -55.2 -51.29 67.03 Favored 'General case' 0 C--O 1.251 1.158 0 C-N-CA 124.17 0.988 . . . . 0.0 109.04 176.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 57.5 t -67.06 -35.09 73.64 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.468 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.43 -36.55 76.1 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 176.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 61.8 m -70.61 -41.86 71.72 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.417 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -61.74 -25.66 67.58 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.88 -37.16 93.89 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.761 -0.654 . . . . 0.0 113.199 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -86.46 2.73 46.77 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.858 -0.201 . . . . 0.0 110.779 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.52 41.38 30.02 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 108.665 -1.774 . . . . 0.0 108.665 -174.082 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -132.83 177.07 7.92 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.783 -0.708 . . . . 0.0 109.227 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.486 ' HB ' HD11 ' A' ' 80' ' ' ILE . 2.7 p -120.9 154.04 36.41 Favored 'General case' 0 C--N 1.279 -2.479 0 O-C-N 123.634 0.584 . . . . 0.0 109.498 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.6 tp -66.05 139.81 58.22 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 172.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.9 tpt -35.82 118.75 0.52 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 114.681 1.364 . . . . 0.0 114.681 -170.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.0 tp -120.51 106.35 11.72 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 -174.525 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.521 HD13 HD11 ' A' ' 50' ' ' LEU . 30.7 mt -98.05 112.96 31.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 CA-C-O 121.25 0.548 . . . . 0.0 111.949 -169.04 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -90.16 -31.22 17.16 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.67 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -143.65 161.54 38.27 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -173.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.9 tt0 -74.32 -25.36 59.51 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 122.536 0.334 . . . . 0.0 110.565 -178.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.657 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 7.7 pt-20 -69.08 -26.13 64.79 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.935 176.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -57.27 -54.1 50.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 173.164 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.521 HD11 HD13 ' A' ' 44' ' ' ILE . 62.4 mt -67.69 -26.8 66.36 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.657 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 4.1 ppt_? -66.45 -36.6 83.18 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -73.44 -25.74 60.64 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.674 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -63.53 -48.82 75.96 Favored 'General case' 0 CA--C 1.477 -1.848 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 172.941 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 37.7 mt -55.12 -38.8 68.65 Favored 'General case' 0 C--O 1.244 0.784 0 O-C-N 123.756 0.66 . . . . 0.0 110.717 177.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -59.16 -43.19 92.1 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.73 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.8 p -81.26 -27.01 35.34 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 53' ' ' LEU . 32.7 mm -67.1 -58.21 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.562 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -178.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? 67.36 -59.07 0.41 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.84 0.856 . . . . 0.0 112.921 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -61.04 -60.36 3.9 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 123.079 0.552 . . . . 0.0 112.418 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt 71.16 15.51 6.47 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.9 0.88 . . . . 0.0 113.044 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 67.0 m-85 -125.59 30.84 5.66 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.631 0.729 . . . . 0.0 111.62 -179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 105' ' ' SER . 65.2 m-80 -127.11 -159.66 0.95 Allowed 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 175.136 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 54.7 m -151.97 126.68 9.54 Favored 'General case' 0 C--O 1.25 1.107 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 173.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.548 ' CE2' HD12 ' A' ' 57' ' ' ILE . 1.1 m-85 -128.83 118.78 23.32 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -176.006 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.408 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 70.3 m95 -59.38 140.14 56.39 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 123.804 0.842 . . . . 0.0 112.018 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -119.53 174.48 4.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 169.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.646 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.84 58.54 3.48 Favored Glycine 0 C--O 1.205 -1.703 0 CA-C-N 119.294 0.952 . . . . 0.0 113.76 -175.006 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.9 mt -127.44 113.86 16.74 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 123.743 0.817 . . . . 0.0 111.282 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -122.42 137.65 54.8 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.553 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -93.52 113.06 25.09 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 9.3 p . . . . . 0 C--N 1.293 -1.875 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.413 -174.858 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 . . . . . 0 CA--C 1.498 -1.056 0 CA-C-O 120.89 0.376 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -87.88 125.4 34.46 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 176.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -124.0 155.3 38.49 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 119.689 -0.804 . . . . 0.0 111.125 175.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.646 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 19.3 m95 -90.53 176.01 6.85 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 114.548 -1.205 . . . . 0.0 108.522 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.486 HD11 ' HB ' ' A' ' 40' ' ' THR . 49.8 pt -72.71 -15.48 17.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -177.639 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.454 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 30.5 p-10 -88.11 -7.97 56.14 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.73 8.08 62.44 Favored Glycine 0 N--CA 1.444 -0.816 0 CA-C-N 114.771 -1.104 . . . . 0.0 113.766 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.4 t -81.09 167.82 19.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.323 0.562 . . . . 0.0 109.613 -179.082 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.1 m -90.46 139.68 30.45 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.551 HD11 HD12 ' A' ' 92' ' ' ILE . 35.0 tp -55.18 138.99 43.48 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.015 173.402 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.481 ' OD1' HG13 ' A' ' 89' ' ' VAL . 26.4 t-20 -98.29 91.46 5.24 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 170.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 39.5 p -71.88 -4.92 30.89 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.3 0.572 . . . . 0.0 111.849 -177.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -75.43 -18.13 59.99 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.555 -178.098 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.481 HG13 ' OD1' ' A' ' 86' ' ' ASN . 33.6 m -75.41 -55.47 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.511 0 C-N-CA 119.111 -1.036 . . . . 0.0 112.494 -177.436 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.514 HD12 HD13 ' A' ' 50' ' ' LEU . 87.0 mt -145.51 -177.8 5.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.014 0.435 . . . . 0.0 111.344 -172.923 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.561 ' O ' ' HB ' ' A' ' 109' ' ' VAL . 10.7 tptm -57.72 98.69 0.03 OUTLIER 'General case' 0 C--O 1.208 -1.093 0 C-N-CA 125.866 1.666 . . . . 0.0 112.182 176.725 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.551 HD12 HD11 ' A' ' 85' ' ' LEU . 4.8 mt -150.69 111.02 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.911 0 N-CA-C 106.822 -1.548 . . . . 0.0 106.822 171.48 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.1 m -71.45 133.7 46.07 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 177.509 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.81 -53.99 3.2 Favored Glycine 0 CA--C 1.47 -2.753 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -173.584 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -96.87 132.02 43.03 Favored 'General case' 0 N--CA 1.421 -1.894 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.9 t -152.25 -19.92 0.17 Allowed 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.804 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 60.88 36.14 19.04 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 123.964 0.906 . . . . 0.0 113.377 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -117.47 171.73 7.8 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.693 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -93.85 28.32 2.43 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 125.762 1.625 . . . . 0.0 108.021 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.401 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 66.8 m -84.11 155.73 22.49 Favored 'General case' 0 N--CA 1.422 -1.854 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -169.358 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 84.0 m -131.63 149.33 52.53 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 105.858 -1.904 . . . . 0.0 105.858 171.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -91.09 146.45 23.83 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -173.166 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.48 144.84 32.16 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.588 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' A' ' 63' ' ' SER . 7.7 mm -77.33 124.74 36.29 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 177.033 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.479 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 23.3 t -94.07 -43.21 8.61 Favored 'General case' 0 N--CA 1.414 -2.233 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 173.73 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.52 -109.36 0.22 Allowed Glycine 0 N--CA 1.418 -2.563 0 N-CA-C 109.12 -1.592 . . . . 0.0 109.12 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -75.81 -19.16 59.16 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -110.89 154.47 24.0 Favored 'General case' 0 C--O 1.259 1.589 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.201 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.561 ' HB ' ' O ' ' A' ' 91' ' ' LYS . 23.6 t -106.0 130.03 58.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 175.018 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.0 p -130.94 151.65 51.13 Favored 'General case' 0 C--N 1.27 -2.887 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -174.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.401 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 19.7 p90 -126.83 133.11 50.83 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 -173.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -129.46 174.51 9.57 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 19.7 m -53.94 129.96 35.84 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.76 0.662 . . . . 0.0 109.224 174.355 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.2 m -58.87 -20.55 52.18 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.864 0.866 . . . . 0.0 112.33 -174.478 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -80.6 -9.08 59.8 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.291 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 51.0 p -68.02 144.8 54.98 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 120.346 -0.541 . . . . 0.0 110.753 -177.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -80.84 89.32 5.83 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.504 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' ASN . . . . . 0.549 ' OD1' ' HB2' ' A' ' 63' ' ' SER . 35.1 m-80 -125.92 170.48 11.63 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.449 -178.123 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.73 ' HB3' ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -89.82 179.6 5.95 Favored 'General case' 0 C--N 1.287 -2.117 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 -178.304 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.411 ' CZ3' HG23 ' A' ' 23' ' ' VAL . 17.9 p90 -153.24 165.01 37.06 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.757 1.162 . . . . 0.0 112.201 -175.236 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.433 HD13 HD12 ' A' ' 53' ' ' LEU . 80.8 mt -120.18 127.31 75.89 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.973 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 70.9 m -106.89 142.58 36.29 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.418 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 2.1 pt20 -124.18 135.93 53.82 Favored 'General case' 0 N--CA 1.417 -2.093 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 171.816 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -108.94 109.25 20.28 Favored 'General case' 0 C--N 1.254 -3.554 0 N-CA-C 105.411 -2.07 . . . . 0.0 105.411 174.058 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -68.62 124.4 23.5 Favored 'General case' 0 N--CA 1.414 -2.241 0 N-CA-C 104.499 -2.408 . . . . 0.0 104.499 174.082 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.709 HD13 ' SG ' ' A' ' 17' ' ' CYS . 6.8 tp . . . . . 0 C--N 1.284 -2.261 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.598 -166.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.522 ' HB2' ' HB3' ' A' ' 126' ' ' LEU . 5.0 mp . . . . . 0 C--O 1.244 0.769 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -95.34 141.17 29.22 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.583 0.706 . . . . 0.0 111.343 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' CYS . . . . . 0.485 ' HB3' HD11 ' A' ' 126' ' ' LEU . 14.6 p -125.95 170.76 8.9 Favored Pre-proline 0 C--N 1.29 -2.006 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.026 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.647 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 52.3 Cg_exo -58.42 152.77 51.99 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 122.855 2.37 . . . . 0.0 112.487 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -58.55 -31.63 68.14 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 -171.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -89.92 8.68 31.03 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.405 0.622 . . . . 0.0 110.641 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.647 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 31.8 m95 -111.4 131.23 55.35 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.913 -176.51 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.7 mm? -85.2 117.71 24.31 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . 0.595 ' HA ' ' SG ' ' A' ' 17' ' ' CYS . 1.8 m -78.95 123.59 27.42 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.96 -175.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 27.7 t-80 -145.29 114.11 6.86 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 122.019 -0.425 . . . . 0.0 110.044 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 71.02 -85.17 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.31 1.044 . . . . 0.0 111.88 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -146.42 19.2 1.36 Allowed 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 123.816 0.847 . . . . 0.0 109.98 -176.384 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.51 ' HG2' ' NE2' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -143.56 160.33 40.82 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 175.961 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.595 ' SG ' ' HA ' ' A' ' 12' ' ' SER . 79.3 m -125.99 142.3 51.58 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 173.543 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -110.8 144.04 40.41 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.738 0.304 . . . . 0.0 111.684 -171.358 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -123.25 109.07 13.5 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 176.337 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.7 t -83.92 91.94 2.86 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.179 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.731 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 6.5 m -78.33 105.84 9.85 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -77.49 14.43 1.0 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.47 1.108 . . . . 0.0 112.65 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.536 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.0 m -108.62 157.92 8.66 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.932 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.4 m -106.84 156.77 18.33 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -171.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 33.4 m-20 -167.81 175.29 6.96 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 128.024 2.53 . . . . 0.0 107.948 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.1 p -82.01 176.61 9.4 Favored 'General case' 0 C--O 1.257 1.471 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 171.348 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -61.81 -50.86 70.62 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.276 49.1 mt-10 -67.68 -30.62 70.19 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.81 -49.26 68.89 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.818 -0.753 . . . . 0.0 110.965 172.756 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.85 -33.9 86.93 Favored Glycine 0 C--N 1.339 0.741 0 N-CA-C 111.522 -0.631 . . . . 0.0 111.522 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.33 -52.87 62.07 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.848 0.859 . . . . 0.0 108.992 176.173 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.48 -31.8 52.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.198 0.523 . . . . 0.0 111.019 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.441 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 1.0 OUTLIER -62.46 -36.38 82.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.487 176.625 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.3 m -68.1 -41.09 82.32 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 175.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -57.36 -35.92 70.56 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.413 0.625 . . . . 0.0 109.622 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -63.08 -14.54 53.63 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 115.013 -0.994 . . . . 0.0 114.061 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LYS . . . . . 0.441 ' HD2' ' O ' ' A' ' 33' ' ' ASP . 3.3 mptp? -108.36 3.54 23.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 117.622 0.711 . . . . 0.0 110.644 176.279 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.87 28.79 66.2 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -174.63 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -118.51 176.84 5.06 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 124.261 1.024 . . . . 0.0 108.705 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -123.52 149.69 44.9 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.56 125.57 25.61 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 177.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.4 tpt -26.62 121.98 0.08 Allowed 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 116.732 2.123 . . . . 0.0 116.732 -169.195 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.441 HD12 ' HB3' ' A' ' 79' ' ' TRP . 2.8 mm? -112.16 105.27 13.57 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.927 1.291 . . . . 0.0 107.599 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.481 HD13 HD11 ' A' ' 50' ' ' LEU . 56.5 mt -85.3 117.94 31.29 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.134 -175.677 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -82.5 -54.49 5.15 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.265 0.555 . . . . 0.0 111.404 179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.583 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 17.1 m-20 -137.04 -179.02 5.46 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 122.119 -0.363 . . . . 0.0 111.072 -171.086 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -39.63 80.72 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 -178.365 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -58.71 -28.26 65.65 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.792 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.583 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 6.5 mm-40 -60.21 -55.18 36.9 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 175.479 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.638 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 46.3 mt -68.85 -26.09 64.97 Favored 'General case' 0 C--O 1.202 -1.424 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -177.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -64.25 -38.32 90.63 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.308 -0.557 . . . . 0.0 109.694 174.686 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -73.1 -28.5 62.32 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.63 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -66.22 -51.89 53.2 Favored 'General case' 0 C--O 1.183 -2.425 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 174.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 50.9 mt -54.8 -33.36 61.39 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -72.89 -46.21 53.98 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.543 174.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.3 p -75.53 -27.04 58.54 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.127 0.489 . . . . 0.0 111.831 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.63 HG12 ' O ' ' A' ' 53' ' ' LEU . 34.2 mm -58.7 -48.92 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.243 174.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? 67.99 -66.41 0.22 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.037 0.935 . . . . 0.0 112.667 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -62.01 -51.28 68.67 Favored 'General case' 0 C--O 1.207 -1.142 0 C-N-CA 123.842 0.857 . . . . 0.0 111.131 -176.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.51 ' H ' HG22 ' A' ' 57' ' ' ILE . 3.8 ttmp? 71.31 -40.85 0.49 Allowed 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -80.81 37.68 0.43 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.787 0.803 . . . . 0.0 112.911 -174.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.607 ' O ' ' HA ' ' A' ' 105' ' ' SER . 54.2 m-80 -124.97 -158.88 0.85 Allowed 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 176.263 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.46 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 15.3 m -143.28 117.82 9.75 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.521 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 2.2 m-85 -122.56 117.5 26.03 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -63.15 139.77 58.81 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 123.063 0.545 . . . . 0.0 111.428 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -117.76 172.76 5.09 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 168.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.59 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -74.92 44.09 1.5 Allowed Glycine 0 C--O 1.216 -1.01 0 CA-C-N 119.132 0.878 . . . . 0.0 114.544 -174.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.509 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 28.8 mt -114.37 123.68 50.07 Favored 'General case' 0 CA--C 1.483 -1.614 0 C-N-CA 123.793 0.837 . . . . 0.0 111.898 -178.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -142.52 140.69 31.91 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 120.086 -0.645 . . . . 0.0 110.076 171.296 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.558 ' HD2' ' O ' ' A' ' 98' ' ' ASN . 82.9 t80 -83.02 113.21 20.43 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 32.5 p . . . . . 0 C--N 1.283 -2.284 0 C-N-CA 119.856 -0.738 . . . . 0.0 112.325 -173.754 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 14.8 m120 . . . . . 0 C--O 1.255 1.35 0 CA-C-O 121.26 0.552 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.507 ' HE1' ' HA2' ' A' ' 94' ' ' GLY . 83.0 m95 -88.92 112.71 23.63 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 173.513 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -116.86 154.64 30.41 Favored 'General case' 0 C--N 1.278 -2.504 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.922 -176.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.59 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 47.2 m95 -98.55 165.5 11.79 Favored 'General case' 0 N--CA 1.425 -1.722 0 CA-C-N 114.504 -1.225 . . . . 0.0 109.353 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.1 pt -73.28 -13.76 16.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.063 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -92.61 -0.66 57.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.396 0.617 . . . . 0.0 109.844 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.46 -2.72 57.59 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.016 -0.993 . . . . 0.0 114.256 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.1 t -84.82 170.6 13.01 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 117.609 0.705 . . . . 0.0 109.852 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.3 m -112.15 145.49 39.72 Favored 'General case' 0 N--CA 1.419 -2.004 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 43.0 tp -53.86 131.98 40.87 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -178.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -86.51 87.85 7.52 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 168.693 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.2 m -64.18 -10.88 25.82 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.923 -177.117 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -77.72 -6.56 54.41 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 22.6 m -74.32 -48.96 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 118.764 -1.174 . . . . 0.0 111.924 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.2 mt -156.72 -178.09 7.09 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 -175.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -73.49 123.31 23.67 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.0 mt -142.59 132.33 22.6 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 N-CA-C 105.721 -1.955 . . . . 0.0 105.721 171.354 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.2 m -112.71 131.94 55.43 Favored 'General case' 0 C--N 1.288 -2.083 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.192 -173.633 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.507 ' HA2' ' HE1' ' A' ' 77' ' ' TRP . . . -91.87 -14.46 56.44 Favored Glycine 0 N--CA 1.426 -2.028 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -77.25 111.16 12.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 174.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 98' ' ' ASN . 5.5 t -171.32 -42.86 0.02 OUTLIER 'General case' 0 C--N 1.274 -2.674 0 CA-C-N 114.473 -1.239 . . . . 0.0 108.43 -175.583 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 68.09 19.06 9.34 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.145 1.378 . . . . 0.0 111.373 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.558 ' O ' ' HD2' ' A' ' 70' ' ' TYR . 26.3 m-80 -121.71 152.9 38.9 Favored 'General case' 0 CA--C 1.498 -1.048 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -72.16 30.46 0.05 Allowed 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 126.346 1.858 . . . . 0.0 110.527 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.452 ' H ' ' C ' ' A' ' 98' ' ' ASN . 41.0 t -62.36 149.07 43.35 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 126.14 1.776 . . . . 0.0 112.802 -172.186 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 90.1 m -112.92 145.31 40.97 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.067 -0.969 . . . . 0.0 108.794 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.481 ' HB1' HG12 ' A' ' 109' ' ' VAL . . . -98.0 147.2 24.74 Favored 'General case' 0 C--O 1.255 1.364 0 CA-C-O 121.3 0.571 . . . . 0.0 111.898 -176.396 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -139.53 152.21 46.74 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.486 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.46 ' O ' ' HA ' ' A' ' 63' ' ' SER . 17.3 mm -77.85 112.53 15.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 N-CA-C 105.388 -2.079 . . . . 0.0 105.388 172.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.607 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 8.5 t -131.82 33.53 3.96 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-O 122.376 1.084 . . . . 0.0 108.511 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.66 -139.82 6.65 Favored Glycine 0 N--CA 1.412 -2.913 0 N-CA-C 108.277 -1.929 . . . . 0.0 108.277 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.433 ' OD2' ' HE3' ' A' ' 108' ' ' LYS . 14.2 p-10 -98.99 8.82 44.64 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.363 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.433 ' HE3' ' OD2' ' A' ' 107' ' ' ASP . 32.4 mmtp -130.43 163.65 26.46 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.102 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.481 HG12 ' HB1' ' A' ' 102' ' ' ALA . 2.8 t -99.11 119.83 47.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.1 p -122.04 143.78 49.3 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.41 ' HA ' ' HA ' ' A' ' 102' ' ' ALA . 23.6 p90 -109.67 145.86 35.8 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -135.76 175.43 9.6 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.79 -1.096 . . . . 0.0 109.942 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.3 m -67.57 127.06 31.33 Favored 'General case' 0 N--CA 1.413 -2.305 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 171.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 20.5 m -56.33 -21.79 26.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.465 0.706 . . . . 0.0 112.585 -173.505 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -77.15 -3.46 39.59 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 30.6 p -75.97 140.39 42.02 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 119.316 0.962 . . . . 0.0 111.389 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.58 89.1 7.05 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.546 0.689 . . . . 0.0 109.444 -177.011 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -120.78 174.38 6.63 Favored 'General case' 0 C--O 1.196 -1.759 0 C-N-CA 124.563 1.145 . . . . 0.0 109.832 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.731 ' HB3' ' O ' ' A' ' 21' ' ' SER . 3.4 mpt_? -85.87 -178.77 6.67 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -176.163 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 24.8 p90 -153.18 162.77 40.93 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 118.688 -1.205 . . . . 0.0 111.999 -176.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 75.6 mt -120.13 125.57 74.37 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-O 121.237 0.542 . . . . 0.0 109.856 178.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 71.7 m -105.24 145.25 30.9 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 176.538 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.51 ' NE2' ' HG2' ' A' ' 16' ' ' LYS . 8.7 pt20 -122.61 133.5 54.54 Favored 'General case' 0 N--CA 1.412 -2.326 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 171.258 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -110.66 108.0 17.76 Favored 'General case' 0 N--CA 1.397 -3.124 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 173.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.462 ' HA ' ' HA ' ' A' ' 16' ' ' LYS . 42.3 tt0 -68.74 134.43 49.77 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-N 113.989 -1.459 . . . . 0.0 108.365 -177.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.522 ' HB3' ' HB2' ' A' ' 4' ' ' LEU . 1.7 mm? . . . . . 0 C--N 1.31 -1.11 0 CA-C-O 121.782 0.801 . . . . 0.0 109.404 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.561 HD13 ' HB3' ' A' ' 126' ' ' LEU . 5.0 mp . . . . . 0 N--CA 1.426 -1.657 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -80.67 140.52 35.6 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.766 0.793 . . . . 0.0 112.583 -176.443 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.8 p -128.18 165.92 27.52 Favored Pre-proline 0 C--N 1.296 -1.759 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.517 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.695 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 52.4 Cg_exo -54.08 162.16 4.34 Favored 'Trans proline' 0 C--N 1.373 1.826 0 C-N-CA 123.222 2.615 . . . . 0.0 115.084 -178.073 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -59.78 -35.49 74.75 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 115.212 1.56 . . . . 0.0 115.212 -173.171 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -89.7 3.08 53.85 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -175.215 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.695 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 16.9 m95 -101.11 153.11 19.86 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.628 -171.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -108.38 124.4 50.31 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.8 p -90.82 126.61 36.08 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -176.098 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.463 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 54.1 t-80 -146.21 115.13 6.93 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 123.002 0.521 . . . . 0.0 110.086 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.25 3.9 mpt_? 53.58 59.14 4.53 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 174.628 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 62.65 24.83 14.78 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.446 174.627 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -145.67 148.01 32.6 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.407 ' SG ' ' HB3' ' A' ' 10' ' ' TRP . 7.3 t -130.78 134.48 46.9 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -176.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.463 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 11.8 m-85 -111.77 149.87 31.09 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -170.765 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.512 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 45.3 t-80 -129.52 116.94 19.68 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 172.619 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.01 93.57 3.87 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 174.535 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.726 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 13.3 m -77.8 107.76 10.54 Favored 'General case' 0 N--CA 1.416 -2.159 0 CA-C-N 115.306 -0.861 . . . . 0.0 108.696 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 77.7 mm-40 -83.55 13.92 4.17 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.603 0.716 . . . . 0.0 111.15 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.478 HG23 ' CH2' ' A' ' 120' ' ' TRP . 5.7 m -100.62 158.32 3.99 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.149 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 118' ' ' ASN . 13.2 m -109.97 151.59 26.93 Favored 'General case' 0 C--N 1.294 -1.81 0 C-N-CA 118.776 -1.17 . . . . 0.0 114.091 -171.034 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -167.09 174.66 8.11 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 127.39 2.276 . . . . 0.0 108.426 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.5 p -86.37 171.89 10.83 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 107.443 -1.318 . . . . 0.0 107.443 170.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -56.54 -52.99 62.68 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -174.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -31.26 70.38 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.956 0.408 . . . . 0.0 111.779 -175.609 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -70.23 -45.25 66.89 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.888 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.88 -32.04 82.83 Favored Glycine 0 C--N 1.341 0.824 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.403 ' HA ' ' HB2' ' A' ' 41' ' ' LEU . 5.0 tt -56.42 -51.21 69.24 Favored 'General case' 0 C--O 1.242 0.682 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 176.234 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.1 t -67.8 -33.24 60.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.839 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -60.11 -37.06 78.87 Favored 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 82.9 m -65.32 -42.35 93.07 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -61.16 -27.73 68.61 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.194 177.122 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -58.64 -34.98 78.89 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.576 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -95.73 8.93 42.09 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 122.26 -0.553 . . . . 0.0 109.704 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.8 43.67 93.58 Favored Glycine 0 CA--C 1.503 -0.68 0 N-CA-C 109.695 -1.362 . . . . 0.0 109.695 -175.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -130.05 174.91 9.33 Favored 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 -177.872 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -119.29 150.83 39.47 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 118.454 0.57 . . . . 0.0 110.972 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 25.9 tp -65.6 124.74 23.17 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 175.404 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.1 tpt -29.98 120.01 0.17 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 -169.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.404 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 2.9 mm? -109.3 110.6 21.82 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 114.191 -1.368 . . . . 0.0 107.505 176.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.9 mt -96.96 117.66 41.93 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -175.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.401 HE22 ' HB3' ' A' ' 43' ' ' LEU . 2.1 mp0 -100.2 -25.1 14.38 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -137.05 160.42 39.01 Favored 'General case' 0 CA--C 1.5 -0.973 0 CA-C-O 120.669 0.271 . . . . 0.0 110.77 -175.085 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -33.97 74.93 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.282 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.3 mp0 -58.6 -29.39 66.42 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.04 178.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -62.17 -54.45 40.86 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.647 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 58.1 mt -65.28 -26.01 67.9 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.355 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -62.9 -41.6 99.49 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -72.45 -28.06 62.7 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.5 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.611 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -64.11 -50.75 67.03 Favored 'General case' 0 C--O 1.18 -2.603 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 175.275 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 51.1 mt -54.86 -35.18 63.74 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 122.878 0.471 . . . . 0.0 111.974 -178.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.04 -42.34 73.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.296 -0.411 . . . . 0.0 112.102 175.18 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.6 p -81.63 -26.43 34.82 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.204 0.526 . . . . 0.0 112.283 -176.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.611 HG12 ' O ' ' A' ' 53' ' ' LEU . 35.4 mm -64.08 -47.36 90.56 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.261 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 tptt 67.1 -68.98 0.14 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.689 1.196 . . . . 0.0 112.62 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -65.48 -47.59 75.55 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -175.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.475 ' H ' HG22 ' A' ' 57' ' ' ILE . 96.0 mttt 75.17 -39.28 0.4 Allowed 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.639 1.176 . . . . 0.0 113.923 177.444 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -73.29 37.84 0.09 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -173.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.575 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 60.9 m-80 -128.0 -163.1 1.23 Allowed 'General case' 0 C--N 1.277 -2.578 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 174.156 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.618 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 50.3 m -139.16 119.54 13.81 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 176.302 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.575 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 6.2 m-85 -120.91 116.17 24.62 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -177.01 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.425 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 71.5 m95 -61.81 138.85 58.37 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 123.596 0.758 . . . . 0.0 111.492 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.14 175.63 4.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.149 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 168.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.645 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.04 47.96 2.33 Favored Glycine 0 C--O 1.209 -1.438 0 C-N-CA 120.784 -0.722 . . . . 0.0 114.375 -174.994 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.7 mt -114.25 121.72 44.57 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 123.283 0.633 . . . . 0.0 111.843 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -129.4 134.29 47.79 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.226 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -87.39 112.82 22.52 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 179.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.516 ' OG1' ' HE2' ' A' ' 78' ' ' LYS . 46.6 p . . . . . 0 C--N 1.307 -1.275 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.128 -172.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 . . . . . 0 N--CA 1.433 -1.283 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.405 ' HE1' ' HA2' ' A' ' 94' ' ' GLY . 77.5 m95 -86.93 119.93 27.67 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 175.305 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' LYS . . . . . 0.516 ' HE2' ' OG1' ' A' ' 71' ' ' THR . 55.9 mttm -113.22 152.29 29.94 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -177.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.645 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 42.5 m95 -98.03 175.91 5.95 Favored 'General case' 0 C--N 1.288 -2.094 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 46.0 pt -71.93 -23.2 21.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 120.95 0.405 . . . . 0.0 111.334 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.3 p-10 -85.69 -9.68 56.83 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.628 0.728 . . . . 0.0 109.69 179.072 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.21 -0.08 44.11 Favored Glycine 0 CA--C 1.495 -1.18 0 CA-C-N 115.39 -0.823 . . . . 0.0 112.382 172.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.1 m -69.8 168.22 15.56 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 28.8 m -108.94 134.43 51.61 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.622 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.496 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 44.3 tp -54.45 142.27 27.85 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 124.84 1.256 . . . . 0.0 114.047 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -96.12 97.1 9.3 Favored 'General case' 0 N--CA 1.432 -1.335 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 169.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.1 m -70.65 -6.11 34.53 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.222 0.534 . . . . 0.0 111.328 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -78.3 -6.21 54.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.079 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.3 m -78.74 -54.47 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.31 0 C-N-CA 119.364 -0.934 . . . . 0.0 112.195 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 91.5 mt -157.37 -178.16 7.14 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.577 0.751 . . . . 0.0 109.188 -174.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.6 98.47 0.37 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -177.881 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.406 HD12 HD11 ' A' ' 85' ' ' LEU . 8.8 mt -139.23 103.54 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 173.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.491 HG22 ' H ' ' A' ' 95' ' ' ASP . 9.7 m -76.05 132.31 40.03 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.086 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLY . . . . . 0.405 ' HA2' ' HE1' ' A' ' 77' ' ' TRP . . . -106.26 12.61 44.14 Favored Glycine 0 CA--C 1.489 -1.559 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -177.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.491 ' H ' HG22 ' A' ' 93' ' ' THR . 7.2 p-10 -140.97 96.73 3.05 Favored 'General case' 0 C--N 1.285 -2.219 0 CA-C-O 121.557 0.694 . . . . 0.0 109.64 176.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.1 t -148.43 -20.48 0.33 Allowed 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.396 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 56.81 82.08 0.12 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.983 0.913 . . . . 0.0 112.888 -177.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -157.0 178.06 10.8 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -108.83 26.17 10.89 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 123.137 1.446 . . . . 0.0 107.475 179.044 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.451 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 19.1 m -66.75 153.42 43.33 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -173.876 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -132.88 145.71 51.17 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 113.606 -1.634 . . . . 0.0 107.0 173.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -92.16 148.24 22.31 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -171.059 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.49 153.32 42.5 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.48 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 63' ' ' SER . 14.2 mm -77.7 120.14 27.75 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 174.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 34.1 t -134.97 94.21 3.12 Favored 'General case' 0 N--CA 1.421 -1.881 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.24 -126.41 8.09 Favored Glycine 0 N--CA 1.429 -1.825 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -102.3 8.39 40.38 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.016 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -126.74 166.83 16.66 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.263 -173.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 t -104.85 133.51 48.82 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.753 0 N-CA-C 104.766 -2.309 . . . . 0.0 104.766 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 43.2 p -127.98 170.47 12.83 Favored 'General case' 0 C--N 1.278 -2.501 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.451 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 11.3 p90 -130.35 125.28 34.23 Favored 'General case' 0 C--N 1.296 -1.758 0 C-N-CA 119.619 -0.832 . . . . 0.0 112.598 178.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -118.06 170.82 8.54 Favored 'General case' 0 C--N 1.294 -1.824 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.712 -172.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 19.1 m -72.0 127.84 33.82 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 170.202 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.6 m -50.71 -22.14 1.95 Allowed 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 125.495 1.518 . . . . 0.0 113.553 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -80.51 7.43 9.93 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 124.387 1.075 . . . . 0.0 111.561 -175.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 18.5 p -92.13 140.38 29.69 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.582 -0.699 . . . . 0.0 111.777 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -78.65 90.42 4.58 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.8 0.81 . . . . 0.0 109.294 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' ASN . . . . . 0.406 ' O ' ' HA ' ' A' ' 24' ' ' SER . 82.8 m-20 -126.61 -178.58 4.42 Favored 'General case' 0 C--O 1.196 -1.746 0 CA-C-N 114.94 -1.027 . . . . 0.0 108.991 -178.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.726 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.7 mpt_? -100.85 -175.44 2.89 Favored 'General case' 0 C--N 1.283 -2.293 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 -175.736 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.478 ' CH2' HG23 ' A' ' 23' ' ' VAL . 26.9 p90 -154.27 169.69 23.05 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 119.492 1.042 . . . . 0.0 112.199 -176.909 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.403 HG13 ' HB3' ' A' ' 64' ' ' PHE . 74.2 mt -122.22 125.74 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 CA-C-O 121.4 0.619 . . . . 0.0 109.855 178.142 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 87.0 m -104.1 142.82 33.8 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.448 -0.796 . . . . 0.0 108.929 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -117.93 132.76 56.37 Favored 'General case' 0 N--CA 1.413 -2.305 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 172.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LYS . . . . . 0.541 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 42.9 tttp -109.98 106.49 16.03 Favored 'General case' 0 C--N 1.251 -3.7 0 N-CA-C 104.048 -2.575 . . . . 0.0 104.048 173.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -83.53 124.73 31.04 Favored 'General case' 0 N--CA 1.41 -2.437 0 CA-C-N 114.357 -1.292 . . . . 0.0 109.902 -170.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.561 ' HB3' HD13 ' A' ' 4' ' ' LEU . 1.5 mm? . . . . . 0 N--CA 1.43 -1.451 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.264 -175.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.6 mp . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -94.31 145.03 25.03 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 118.419 0.554 . . . . 0.0 111.189 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 71.0 m -113.25 164.08 16.55 Favored Pre-proline 0 C--N 1.301 -1.511 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.475 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 38.5 Cg_exo -60.75 157.67 36.6 Favored 'Trans proline' 0 C--N 1.368 1.573 0 C-N-CA 121.448 1.432 . . . . 0.0 110.956 174.028 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -44.13 -45.35 8.17 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -92.47 2.18 56.82 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.513 -172.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.475 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 23.9 m95 -99.98 126.87 46.22 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.793 0.806 . . . . 0.0 111.788 -173.781 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.2 tp -84.69 119.41 25.22 Favored 'General case' 0 N--CA 1.412 -2.347 0 CA-C-N 113.753 -1.567 . . . . 0.0 108.081 -175.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.6 t -92.72 130.79 38.23 Favored 'General case' 0 C--N 1.272 -2.781 0 CA-C-O 120.897 0.38 . . . . 0.0 111.092 -173.078 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.459 ' CE1' ' HG2' ' A' ' 14' ' ' ARG . 48.3 t-80 -153.31 130.03 10.83 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 123.212 0.605 . . . . 0.0 109.696 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.459 ' HG2' ' CE1' ' A' ' 13' ' ' HIS . 24.0 mmt180 65.11 -81.04 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.439 1.495 . . . . 0.0 113.011 178.677 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -157.77 26.07 0.27 Allowed 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 -174.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -141.98 163.75 32.03 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.441 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.676 ' SG ' HD13 ' A' ' 126' ' ' LEU . 13.1 m -123.96 131.07 53.51 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 176.402 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.432 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 22.6 m-85 -111.15 135.73 51.23 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 120.999 0.428 . . . . 0.0 111.907 -175.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -121.53 102.08 8.02 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 173.218 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -81.1 95.18 2.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.753 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 9.4 m -77.77 108.03 10.71 Favored 'General case' 0 N--CA 1.414 -2.248 0 CA-C-N 115.416 -0.811 . . . . 0.0 108.98 -178.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -83.34 14.79 3.34 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.997 0.919 . . . . 0.0 112.67 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.472 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.4 m -105.7 158.89 6.02 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.801 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 178.52 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -111.4 148.38 33.18 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -171.815 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -158.15 -176.69 6.06 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 127.379 2.272 . . . . 0.0 107.825 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.7 p -84.68 176.62 8.45 Favored 'General case' 0 C--O 1.258 1.525 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 171.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.9 t90 -63.02 -47.0 84.93 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.443 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 43.1 mt-10 -67.76 -38.01 82.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.946 -177.013 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.33 -46.07 85.13 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.456 -0.498 . . . . 0.0 111.429 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.9 -35.66 92.33 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 120.165 -1.017 . . . . 0.0 111.574 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 3.2 tm? -55.39 -52.16 64.45 Favored 'General case' 0 C--O 1.249 1.043 0 C-N-CA 123.797 0.839 . . . . 0.0 108.999 176.005 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 84.8 t -68.1 -32.59 56.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.971 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.8 -36.35 80.86 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.783 177.179 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.0 m -69.38 -40.37 77.47 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -60.44 -29.42 69.0 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.369 0.604 . . . . 0.0 109.589 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -60.76 -30.24 72.16 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.248 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -96.8 1.86 51.21 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 117.245 0.522 . . . . 0.0 111.027 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.0 53.28 9.55 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 108.53 -1.828 . . . . 0.0 108.53 -172.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -147.3 177.28 9.34 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.437 ' HB ' HD11 ' A' ' 80' ' ' ILE . 11.2 p -120.85 159.56 25.24 Favored 'General case' 0 C--N 1.284 -2.28 0 C-N-CA 122.917 0.487 . . . . 0.0 110.402 -176.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.7 tp -73.97 131.62 41.59 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 174.635 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.4 tpt -29.38 122.7 0.15 Allowed 'General case' 0 N--CA 1.506 2.333 0 N-CA-C 116.77 2.137 . . . . 0.0 116.77 -170.392 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.481 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 2.9 mm? -112.94 108.09 16.89 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.552 HD13 HD11 ' A' ' 50' ' ' LEU . 54.4 mt -83.38 118.15 30.43 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.7 0 O-C-N 122.211 -0.305 . . . . 0.0 110.556 -175.617 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -79.73 -45.79 18.26 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.16 -178.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -154.15 179.85 8.56 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -174.293 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.3 -36.27 79.08 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -60.3 -27.89 67.67 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.498 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -68.17 -52.13 38.05 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.152 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.554 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.4 mt -66.22 -24.26 66.58 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -64.71 -35.93 82.65 Favored 'General case' 0 N--CA 1.393 -3.285 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -72.1 -31.74 66.34 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.265 175.198 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.607 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.4 mm? -64.21 -52.67 57.69 Favored 'General case' 0 C--O 1.192 -1.922 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.922 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 45.4 mt -54.77 -40.63 69.59 Favored 'General case' 0 C--O 1.252 1.233 0 C-N-CA 123.178 0.591 . . . . 0.0 112.246 -177.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -70.2 -36.8 74.85 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 178.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.8 p -81.96 -33.55 30.19 Favored 'General case' 0 C--N 1.31 -1.152 0 C-N-CA 120.824 -0.351 . . . . 0.0 111.451 -178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.1 mm -56.07 -45.97 80.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.609 0 C-N-CA 123.878 0.871 . . . . 0.0 109.545 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? 66.12 -68.64 0.13 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.435 1.094 . . . . 0.0 113.093 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -60.36 -38.64 84.5 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 124.656 1.183 . . . . 0.0 114.182 -174.222 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.536 ' H ' HG22 ' A' ' 57' ' ' ILE . 41.8 mmtm 71.94 -53.34 0.69 Allowed 'General case' 0 C--O 1.212 -0.913 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 175.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -67.3 35.16 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 126.321 1.848 . . . . 0.0 114.494 -171.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.472 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 14.0 m120 -127.49 -173.61 2.96 Favored 'General case' 0 C--N 1.273 -2.749 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 177.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.681 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 50.2 m -142.66 121.9 13.03 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 177.301 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.472 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 3.0 m-85 -123.64 117.6 25.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -176.463 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.403 ' CE2' ' HB2' ' A' ' 118' ' ' ASN . 78.9 m95 -60.77 139.02 58.05 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 123.53 0.732 . . . . 0.0 111.207 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -119.48 176.25 3.53 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 170.51 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.517 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.94 48.41 2.7 Favored Glycine 0 C--O 1.22 -0.745 0 CA-C-N 118.736 0.698 . . . . 0.0 114.128 -174.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.452 HD21 HD13 ' A' ' 85' ' ' LEU . 48.3 mt -113.1 115.42 28.28 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 123.295 0.638 . . . . 0.0 112.105 -179.046 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -126.22 146.81 49.83 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 173.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' TYR . . . . . 0.442 ' HD2' ' O ' ' A' ' 98' ' ' ASN . 30.0 t80 -96.37 113.19 24.76 Favored 'General case' 0 C--N 1.277 -2.582 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -177.111 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 17.1 p . . . . . 0 C--N 1.297 -1.7 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.69 -175.341 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 86.3 m-20 . . . . . 0 N--CA 1.419 -2.003 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -92.62 138.14 31.76 Favored 'General case' 0 C--N 1.281 -2.399 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -177.837 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -118.87 152.42 36.31 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.611 ' HB2' ' OD1' ' A' ' 81' ' ' ASN . 23.7 m95 -98.2 170.76 8.66 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 115.463 -0.79 . . . . 0.0 108.909 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.437 HD11 ' HB ' ' A' ' 40' ' ' THR . 48.1 pt -73.23 -12.33 15.47 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.882 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.611 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 33.3 p-10 -86.17 -8.08 58.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.243 0.544 . . . . 0.0 109.665 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.39 6.48 57.54 Favored Glycine 0 CA--C 1.523 0.577 0 CA-C-N 114.903 -1.044 . . . . 0.0 113.473 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.5 t -96.05 174.16 7.06 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -178.286 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 59.3 m -106.55 145.55 31.72 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 121.256 0.551 . . . . 0.0 109.864 177.138 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.52 HD11 HD12 ' A' ' 92' ' ' ILE . 28.4 tp -54.23 144.21 20.77 Favored 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 125.987 1.715 . . . . 0.0 113.41 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -92.34 89.83 6.99 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 170.192 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.8 m -70.37 -12.24 61.45 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.486 -175.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -77.66 -10.66 59.64 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.435 -176.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.4 m -75.46 -51.28 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -176.083 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.0 mt -155.21 -177.96 6.91 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -173.557 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.413 ' HD2' ' HB3' ' A' ' 108' ' ' LYS . 0.0 OUTLIER -63.98 102.67 0.51 Allowed 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 114.72 1.378 . . . . 0.0 114.72 -179.064 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.52 HD12 HD11 ' A' ' 85' ' ' LEU . 7.7 mt -143.47 98.65 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 171.096 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.1 m -60.49 127.69 32.95 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.364 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.96 -43.8 5.89 Favored Glycine 0 N--CA 1.414 -2.808 0 N-CA-C 108.78 -1.728 . . . . 0.0 108.78 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -85.96 85.44 7.37 Favored 'General case' 0 N--CA 1.428 -1.575 0 CA-C-O 122.727 1.251 . . . . 0.0 110.925 177.802 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.1 t -122.16 -32.33 3.7 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.394 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 56.06 34.36 23.62 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.935 0.894 . . . . 0.0 111.811 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' ASN . . . . . 0.442 ' O ' ' HD2' ' A' ' 70' ' ' TYR . 35.1 m-80 -108.57 -171.7 1.91 Allowed 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.829 176.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -119.52 25.75 9.85 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-O 123.019 1.39 . . . . 0.0 107.299 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.424 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 22.9 t -73.9 157.65 35.89 Favored 'General case' 0 C--N 1.298 -1.65 0 CA-C-N 113.854 -1.521 . . . . 0.0 111.544 -174.323 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 72.2 m -121.59 144.89 48.48 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ALA . . . . . 0.455 ' HA ' ' HA ' ' A' ' 111' ' ' PHE . . . -95.31 150.48 20.21 Favored 'General case' 0 C--O 1.251 1.15 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -173.883 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.19 154.43 43.85 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 124.571 1.148 . . . . 0.0 109.664 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.681 ' O ' ' HA ' ' A' ' 63' ' ' SER . 14.1 mm -77.65 116.27 20.87 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.354 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 173.404 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 6.4 t -129.3 93.11 3.49 Favored 'General case' 0 N--CA 1.405 -2.685 0 N-CA-C 106.749 -1.574 . . . . 0.0 106.749 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 87.79 -133.51 11.85 Favored Glycine 0 N--CA 1.431 -1.668 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' ASP . . . . . 0.487 ' OD2' ' HE2' ' A' ' 60' ' ' LYS . 8.1 m-20 -97.73 15.05 24.79 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 174.272 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 108' ' ' LYS . . . . . 0.413 ' HB3' ' HD2' ' A' ' 91' ' ' LYS . 29.8 mmtp -125.38 168.99 12.79 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.706 -174.3 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.2 t -115.53 133.32 62.25 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.003 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 173.48 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.7 p -129.15 167.79 17.08 Favored 'General case' 0 C--N 1.278 -2.514 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.455 ' HA ' ' HA ' ' A' ' 102' ' ' ALA . 6.2 p90 -122.74 128.08 50.04 Favored 'General case' 0 C--N 1.285 -2.234 0 CA-C-O 121.444 0.64 . . . . 0.0 111.105 176.78 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.401 ' HB2' ' CH2' ' A' ' 65' ' ' TRP . 21.4 mm-40 -120.81 170.02 9.86 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.805 -172.402 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.9 m -65.78 128.41 35.89 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 170.25 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 11.7 m -61.21 -18.91 60.64 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.242 0.617 . . . . 0.0 112.292 -172.901 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -88.84 0.16 56.8 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.935 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 64.7 p -80.32 150.09 30.05 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.989 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -76.76 106.15 8.25 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.142 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' ASN . . . . . 0.403 ' HB2' ' CE2' ' A' ' 65' ' ' TRP . 78.2 m-20 -143.67 172.46 12.79 Favored 'General case' 0 CA--C 1.489 -1.372 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.753 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.6 mpt_? -93.74 -174.82 3.56 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 -177.398 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 24.4 p90 -155.36 167.56 29.98 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 119.897 1.226 . . . . 0.0 111.619 -177.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.45 HD13 HD12 ' A' ' 53' ' ' LEU . 79.5 mt -124.06 123.55 66.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-O 121.234 0.54 . . . . 0.0 110.052 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 79.0 m -100.84 138.93 37.23 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.103 176.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.552 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 1.9 pt20 -123.43 140.49 52.95 Favored 'General case' 0 N--CA 1.413 -2.293 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 173.3 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -109.5 124.31 50.86 Favored 'General case' 0 C--N 1.246 -3.91 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 175.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -72.22 114.22 10.1 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 177.166 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.676 HD13 ' SG ' ' A' ' 17' ' ' CYS . 13.6 tp . . . . . 0 C--N 1.301 -1.501 0 CA-C-N 114.274 -1.33 . . . . 0.0 110.224 -171.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.8 mp . . . . . 0 CA--C 1.55 0.968 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -86.71 141.03 29.2 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 118.621 0.646 . . . . 0.0 112.178 -177.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.9 m -120.68 156.06 56.41 Favored Pre-proline 0 C--N 1.309 -1.186 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.955 177.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.492 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 15.4 Cg_exo -66.36 164.41 28.45 Favored 'Trans proline' 0 CA--C 1.55 1.279 0 C-N-CA 121.733 1.622 . . . . 0.0 111.344 174.445 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLN . . . . . 0.425 ' HG3' ' N ' ' A' ' 9' ' ' ASP . 11.4 pt20 -50.73 -46.1 58.92 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -173.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.425 ' N ' ' HG3' ' A' ' 8' ' ' GLN . 22.4 m-20 -92.74 24.29 3.67 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 120.749 0.309 . . . . 0.0 111.282 -173.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.492 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 26.6 m95 -122.17 131.98 54.22 Favored 'General case' 0 C--N 1.295 -1.802 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.527 -177.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.35 135.97 33.12 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 177.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.1 t -98.48 123.3 42.55 Favored 'General case' 0 C--N 1.292 -1.92 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.112 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.404 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 43.0 t-80 -130.39 108.15 9.77 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.938 -0.476 . . . . 0.0 110.949 179.147 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 59.59 -68.63 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 126.451 1.901 . . . . 0.0 113.642 177.236 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -147.8 19.66 1.15 Allowed 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.427 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.583 ' HG3' ' HA ' ' A' ' 125' ' ' GLU . 3.9 mppt? -150.87 151.99 33.03 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.231 0.612 . . . . 0.0 109.926 176.672 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.698 ' SG ' HD13 ' A' ' 126' ' ' LEU . 8.3 m -108.22 136.71 47.43 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 177.507 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.424 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 13.6 m-85 -113.27 142.0 46.34 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 118.669 0.668 . . . . 0.0 111.546 -176.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' HIS . . . . . 0.443 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 60.8 t-80 -128.15 112.57 14.7 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 175.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.8 t -94.12 98.57 8.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.163 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.762 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 4.8 m -77.69 117.86 19.5 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -86.97 14.39 7.46 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.855 0.836 . . . . 0.0 111.726 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.499 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 7.2 m -111.44 156.31 12.61 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.295 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 55.1 m -103.51 158.98 15.98 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -173.258 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 36.5 m-20 -162.96 170.98 17.25 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 127.716 2.407 . . . . 0.0 107.896 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.7 p -81.64 165.62 20.9 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 170.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -58.42 -50.95 71.86 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.737 0.699 . . . . 0.0 112.051 -174.53 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.443 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 38.6 mt-10 -66.26 -32.01 73.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.596 0.712 . . . . 0.0 110.793 -176.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -70.42 -44.56 67.65 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.454 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.33 -35.22 91.77 Favored Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 2.7 tm? -55.68 -52.26 64.45 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.77 -35.06 74.27 Favored 'Isoleucine or valine' 0 C--O 1.244 0.778 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.68 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.05 -36.5 81.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.726 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.6 m -67.44 -42.6 82.86 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 176.557 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.75 -23.11 67.03 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.217 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.96 -33.91 87.12 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.169 176.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -93.94 10.22 34.26 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.284 -0.539 . . . . 0.0 110.056 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 40.85 84.52 Favored Glycine 0 CA--C 1.495 -1.176 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.547 ' HB1' ' O ' ' A' ' 123' ' ' GLN . . . -131.28 176.79 7.99 Favored 'General case' 0 N--CA 1.416 -2.125 0 CA-C-N 114.723 -0.738 . . . . 0.0 109.29 -176.321 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -117.62 162.14 18.51 Favored 'General case' 0 C--N 1.284 -2.269 0 C-N-CA 123.24 0.616 . . . . 0.0 109.571 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.3 tp -81.1 121.95 26.73 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.8 tpt -21.05 118.42 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 117.291 2.33 . . . . 0.0 117.291 -168.633 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.467 HD23 ' NE2' ' A' ' 123' ' ' GLN . 3.2 mm? -112.09 105.9 14.39 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.816 1.246 . . . . 0.0 108.127 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.414 ' HB ' ' CH2' ' A' ' 79' ' ' TRP . 24.2 mt -93.73 130.43 42.71 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -175.406 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -110.08 -26.36 9.73 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.994 176.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.426 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 14.6 t70 -136.96 167.25 21.85 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.291 -173.443 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -37.55 75.02 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.162 0.985 . . . . 0.0 108.556 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 6.6 pt-20 -60.3 -27.29 67.19 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-O 121.197 0.522 . . . . 0.0 110.688 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.426 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 1.6 mt-10 -63.54 -54.62 33.26 Favored 'General case' 0 N--CA 1.422 -1.842 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.644 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 51.2 mt -68.44 -27.73 66.44 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.585 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 16.5 ptt180 -66.02 -34.81 78.95 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.564 -0.854 . . . . 0.0 108.901 177.102 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -72.44 -33.69 67.25 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 177.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.659 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -61.11 -49.46 77.21 Favored 'General case' 0 CA--C 1.48 -1.717 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 54.2 mt -56.18 -34.51 66.28 Favored 'General case' 0 C--N 1.314 -0.951 0 O-C-N 123.563 0.539 . . . . 0.0 112.092 -178.664 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.69 -44.58 85.75 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.86 0.362 . . . . 0.0 110.66 175.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 35.1 p -76.6 -27.55 55.81 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.019 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 53' ' ' LEU . 42.9 mm -66.79 -55.77 16.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.6 tptm 66.05 -63.23 0.24 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.855 1.262 . . . . 0.0 113.492 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -65.52 -39.93 92.37 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 122.69 0.396 . . . . 0.0 111.583 -175.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.557 ' H ' HG22 ' A' ' 57' ' ' ILE . 94.6 mttt 70.99 -47.3 0.65 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 173.219 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -67.3 -1.0 3.98 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 115.359 1.615 . . . . 0.0 115.359 -170.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.592 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 61.7 m-80 -82.04 -160.98 0.4 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.215 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 18.9 m -142.63 114.03 7.85 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.592 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 2.7 m-85 -121.61 118.52 29.41 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 117.636 0.198 . . . . 0.0 110.696 -175.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' TRP . . . . . 0.4 ' CH2' ' HB2' ' A' ' 112' ' ' GLU . 74.9 m95 -62.33 142.91 57.54 Favored 'General case' 0 C--N 1.312 -1.048 0 C-N-CA 123.239 0.616 . . . . 0.0 112.018 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.15 176.28 4.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 168.106 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.585 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.15 47.06 2.55 Favored Glycine 0 C--O 1.217 -0.92 0 CA-C-N 118.71 0.686 . . . . 0.0 114.309 -174.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.9 mt -112.13 118.56 35.69 Favored 'General case' 0 CA--C 1.494 -1.184 0 C-N-CA 123.818 0.847 . . . . 0.0 111.209 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -127.39 136.08 51.36 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.08 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -90.46 112.7 24.43 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 177.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.4 p . . . . . 0 C--N 1.298 -1.667 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.04 -175.184 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 20.1 m120 . . . . . 0 CA--C 1.489 -1.4 0 CA-C-O 120.996 0.427 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -94.01 107.05 19.0 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 171.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -105.28 145.98 29.96 Favored 'General case' 0 C--N 1.275 -2.64 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.807 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.585 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 47.8 m95 -87.25 165.02 15.98 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 176.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 47.0 pt -67.19 -17.83 23.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.515 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 32.7 p-10 -85.9 -9.59 56.68 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.171 0.51 . . . . 0.0 109.742 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.75 8.23 55.95 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.649 -0.705 . . . . 0.0 114.234 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.2 t -85.37 174.8 9.29 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 117.537 0.668 . . . . 0.0 109.911 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 88.0 m -101.18 140.68 35.14 Favored 'General case' 0 N--CA 1.42 -1.944 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.615 HD11 HD12 ' A' ' 92' ' ' ILE . 40.8 tp -53.92 132.56 42.21 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 178.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -92.47 81.86 4.87 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 170.657 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.4 p -71.74 -11.99 61.09 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.361 0.601 . . . . 0.0 111.19 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -77.34 -1.45 30.0 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.664 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 33.7 m -80.7 -47.69 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.446 174.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.408 ' HB2' HG23 ' A' ' 109' ' ' VAL . 95.5 mt -154.86 177.79 10.89 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.528 0.731 . . . . 0.0 109.147 -175.3 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -67.52 117.05 8.94 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -175.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.615 HD12 HD11 ' A' ' 85' ' ' LEU . 8.8 mt -149.86 114.57 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 172.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.7 m -69.88 128.66 37.15 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -81.45 -30.69 35.95 Favored Glycine 0 N--CA 1.418 -2.503 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -174.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -112.7 117.37 32.04 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.5 t -142.73 -19.89 0.67 Allowed 'General case' 0 C--N 1.289 -2.025 0 C-N-CA 119.041 -1.064 . . . . 0.0 111.199 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 49.86 64.77 1.64 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.732 0.777 . . . . 0.0 112.765 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -141.97 167.3 22.46 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.857 -174.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -90.54 29.14 1.34 Allowed 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 126.905 2.082 . . . . 0.0 107.48 175.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' SER . . . . . 0.428 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 21.7 t -91.43 151.24 20.89 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 113.738 -1.574 . . . . 0.0 113.51 -171.089 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 66.8 m -130.87 151.63 51.08 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 174.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -92.76 149.51 21.25 Favored 'General case' 0 C--O 1.251 1.139 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -173.867 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.1 148.15 36.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.396 1.078 . . . . 0.0 110.328 -178.172 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.433 HD11 HD22 ' A' ' 50' ' ' LEU . 12.1 mm -77.07 125.61 37.02 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 C-N-CA 124.348 1.059 . . . . 0.0 108.414 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 8.8 t -149.85 95.34 2.3 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.444 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . 105.51 -143.19 15.65 Favored Glycine 0 C--N 1.296 -1.657 0 N-CA-C 109.083 -1.607 . . . . 0.0 109.083 -178.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -99.03 15.03 27.12 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -128.19 171.3 12.07 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.767 -173.733 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.408 HG23 ' HB2' ' A' ' 90' ' ' LEU . 10.5 t -104.21 142.46 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.654 0 N-CA-C 105.615 -1.995 . . . . 0.0 105.615 173.804 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.3 p -131.88 175.73 8.96 Favored 'General case' 0 C--N 1.278 -2.508 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 178.055 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' PHE . . . . . 0.428 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 19.4 p90 -138.9 139.04 37.93 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 119.229 0.922 . . . . 0.0 112.743 177.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLU . . . . . 0.4 ' HB2' ' CH2' ' A' ' 65' ' ' TRP . 16.8 mm-40 -125.24 168.5 13.38 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 -177.624 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.0 m -66.9 136.2 55.01 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 174.087 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 33.8 m -57.62 -16.88 11.71 Favored 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -173.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -95.41 7.95 44.7 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 123.683 0.793 . . . . 0.0 110.491 -173.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 51.1 p -90.67 140.06 30.13 Favored 'General case' 0 N--CA 1.427 -1.576 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.893 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -75.93 106.5 7.55 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.449 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -141.25 172.22 12.98 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 124.077 0.951 . . . . 0.0 108.684 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.762 ' HB3' ' O ' ' A' ' 21' ' ' SER . 4.7 mpt_? -83.3 -179.68 7.45 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 15.3 p90 -154.56 161.95 41.38 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 118.092 -1.443 . . . . 0.0 112.375 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 82.0 mt -119.83 122.25 68.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.415 0.626 . . . . 0.0 110.282 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 79.4 m -100.46 148.81 24.34 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.955 177.081 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.547 ' O ' ' HB1' ' A' ' 39' ' ' ALA . 5.4 pt20 -125.98 139.05 53.75 Favored 'General case' 0 N--CA 1.418 -2.028 0 N-CA-C 106.733 -1.581 . . . . 0.0 106.733 172.306 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -109.51 109.04 19.73 Favored 'General case' 0 C--N 1.259 -3.343 0 N-CA-C 103.699 -2.704 . . . . 0.0 103.699 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 125' ' ' GLU . . . . . 0.583 ' HA ' ' HG3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -63.72 116.44 5.72 Favored 'General case' 0 N--CA 1.424 -1.747 0 CA-C-O 122.17 0.986 . . . . 0.0 109.406 -176.98 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.698 HD13 ' SG ' ' A' ' 17' ' ' CYS . 12.4 tp . . . . . 0 N--CA 1.415 -2.178 0 CA-C-N 113.923 -1.49 . . . . 0.0 108.188 -170.547 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.417 HD13 ' HG ' ' A' ' 126' ' ' LEU . 3.9 mp . . . . . 0 N--CA 1.446 -0.638 0 N-CA-C 105.53 -2.026 . . . . 0.0 105.53 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -115.74 139.34 50.25 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 119.764 1.165 . . . . 0.0 112.25 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.5 m -101.4 157.06 34.39 Favored Pre-proline 0 C--N 1.303 -1.449 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.904 -177.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -64.98 164.18 25.78 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 121.713 1.609 . . . . 0.0 111.667 175.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -49.66 -44.57 47.82 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -176.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -80.83 15.43 1.78 Allowed 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -125.85 153.77 43.64 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.468 -0.77 . . . . 0.0 112.712 -172.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -94.83 -176.69 3.94 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 169.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.5 p -148.22 140.99 24.63 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 120.248 -0.581 . . . . 0.0 111.605 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -148.96 108.31 3.95 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 176.839 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 70.29 -85.35 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 125.366 1.466 . . . . 0.0 111.524 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -138.52 27.65 2.5 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.789 -174.916 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -145.57 157.23 44.01 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 176.404 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.644 ' SG ' HD13 ' A' ' 126' ' ' LEU . 7.6 m -112.69 140.79 47.17 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.008 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -116.63 145.77 43.17 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 118.801 0.728 . . . . 0.0 111.44 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -137.52 106.57 5.99 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.217 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.5 t -90.05 101.59 12.39 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.793 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.066 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.709 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 5.5 m -78.13 111.17 13.77 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -79.01 14.73 1.3 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.77 0.828 . . . . 0.0 113.027 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.583 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 15.6 m -111.65 156.11 12.84 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 m -102.54 141.9 34.6 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -171.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.39 169.73 21.83 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 128.084 2.554 . . . . 0.0 106.842 -179.113 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 38.2 p -80.45 169.88 17.11 Favored 'General case' 0 C--O 1.253 1.278 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 169.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TRP . . . . . 0.473 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 92.9 t90 -57.42 -49.04 77.49 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.743 0.306 . . . . 0.0 111.314 -176.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.05 -35.14 79.21 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.444 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -61.73 -47.77 83.74 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 120.519 0.199 . . . . 0.0 110.715 176.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.4 -35.87 92.63 Favored Glycine 0 CA--C 1.504 -0.631 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.252 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.99 -50.94 72.19 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 96.7 t -64.14 -32.99 59.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.504 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.19 -36.69 84.48 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.945 175.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 60.5 m -68.04 -39.78 83.01 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.43 -33.16 69.39 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 121.162 0.505 . . . . 0.0 109.842 176.38 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -60.03 -28.3 66.1 Favored Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 114.914 -1.039 . . . . 0.0 113.517 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -99.37 5.8 46.28 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 117.346 0.573 . . . . 0.0 110.302 177.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.5 49.94 41.02 Favored Glycine 0 N--CA 1.44 -1.046 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -174.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.28 177.38 9.05 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -118.88 165.59 13.87 Favored 'General case' 0 C--N 1.29 -2.014 0 C-N-CA 122.623 0.369 . . . . 0.0 110.587 -178.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.7 tp -77.54 132.02 38.15 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 18.1 tpt -30.38 121.93 0.19 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.449 HD12 ' HB3' ' A' ' 79' ' ' TRP . 2.6 mm? -114.39 98.64 7.04 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.124 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.502 HD13 HD21 ' A' ' 50' ' ' LEU . 40.8 mt -79.04 123.33 35.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -177.238 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 71.9 mm-40 -100.36 -20.63 15.75 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 120.055 -0.658 . . . . 0.0 112.45 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.512 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 21.3 t70 -159.72 169.69 23.14 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -174.715 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -73.34 -21.32 60.57 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 117.942 0.337 . . . . 0.0 110.781 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.471 ' HB2' ' OD2' ' A' ' 46' ' ' ASP . 0.5 OUTLIER -57.85 -34.41 69.7 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 123.847 0.859 . . . . 0.0 109.109 175.365 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.512 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 3.5 mm-40 -63.16 -55.04 28.54 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.296 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.636 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 79.6 mt -65.8 -24.81 67.0 Favored 'General case' 0 CA--C 1.496 -1.126 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -63.32 -44.93 93.53 Favored 'General case' 0 N--CA 1.402 -2.835 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -73.0 -25.28 60.92 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.654 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.674 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -63.52 -51.39 65.71 Favored 'General case' 0 C--O 1.184 -2.377 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.32 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 39.4 mt -51.96 -40.51 60.97 Favored 'General case' 0 C--N 1.311 -1.077 0 O-C-N 123.882 0.739 . . . . 0.0 111.562 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.34 -40.1 95.2 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.092 176.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.3 p -85.61 -9.69 56.93 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.468 0.651 . . . . 0.0 111.793 -179.126 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.8 mm -83.54 -52.4 13.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.083 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? 68.24 -69.86 0.14 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.209 1.004 . . . . 0.0 112.732 -178.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -59.12 -59.92 4.7 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 123.049 0.539 . . . . 0.0 111.895 -175.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.437 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 45.9 mtmt 75.03 -10.83 1.15 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.81 1.244 . . . . 0.0 112.772 -177.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -77.54 -21.95 51.83 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.682 0.277 . . . . 0.0 111.708 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 30.2 m-80 -78.84 -169.62 1.84 Allowed 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 15.9 m -140.96 122.97 15.53 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.592 -1.632 . . . . 0.0 106.592 178.113 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.8 m-85 -124.5 120.21 31.36 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -174.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -63.57 137.75 58.24 Favored 'General case' 0 C--N 1.311 -1.107 0 O-C-N 123.64 0.587 . . . . 0.0 111.451 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.67 175.13 2.86 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 168.766 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.584 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.53 44.55 2.25 Favored Glycine 0 C--O 1.216 -0.995 0 CA-C-N 118.792 0.724 . . . . 0.0 114.277 -174.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LEU . . . . . 0.478 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 14.9 mt -113.51 123.81 50.9 Favored 'General case' 0 CA--C 1.486 -1.498 0 C-N-CA 124.154 0.981 . . . . 0.0 111.534 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -133.09 144.66 50.13 Favored 'General case' 0 C--N 1.295 -1.786 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.037 171.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -85.15 128.86 34.83 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 177.395 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.5 p . . . . . 0 C--N 1.278 -2.52 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -173.581 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 . . . . . 0 N--CA 1.431 -1.407 0 CA-C-O 121.137 0.494 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -103.29 118.47 36.84 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -125.58 157.29 37.52 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.509 177.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.584 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.0 m95 -95.62 165.76 12.17 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.02 -178.128 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 pt -67.11 -17.03 22.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.464 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 26.7 p-10 -86.26 -15.98 39.05 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.11 8.49 36.09 Favored Glycine 0 C--N 1.317 -0.523 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.665 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.7 m -80.0 162.39 24.91 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 122.617 0.367 . . . . 0.0 111.304 175.443 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 27.1 m -99.93 140.57 33.96 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.465 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 48.9 tp -68.21 133.21 48.49 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -89.26 91.07 8.62 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 167.195 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.2 m -70.99 -7.99 50.1 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.599 -177.638 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -77.75 -4.46 46.45 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.6 m -75.11 -52.95 17.4 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 118.646 -1.221 . . . . 0.0 110.939 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.5 mt -144.29 -178.44 5.97 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -176.455 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.411 ' HB2' ' HE3' ' A' ' 91' ' ' LYS . 18.8 ptmt -69.41 111.53 5.35 Favored 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -177.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.425 HD12 HD21 ' A' ' 85' ' ' LEU . 9.4 mt -146.67 120.18 2.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.239 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 173.196 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 95' ' ' ASP . 8.0 m -101.42 138.22 38.71 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 120.631 0.253 . . . . 0.0 110.6 -173.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -95.18 -15.29 45.21 Favored Glycine 0 N--CA 1.432 -1.624 0 N-CA-C 109.864 -1.294 . . . . 0.0 109.864 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ASP . . . . . 0.419 ' H ' HG22 ' A' ' 93' ' ' THR . 4.2 m-20 -83.03 114.79 21.52 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 174.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.0 t -170.18 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.61 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 67.64 17.3 9.89 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -177.692 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -102.41 -171.33 1.94 Allowed 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -118.31 26.63 9.48 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 105.908 -1.886 . . . . 0.0 105.908 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 32.3 t -66.2 158.87 27.69 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 112.302 -2.226 . . . . 0.0 113.654 -172.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -135.1 154.56 51.63 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 124.831 1.253 . . . . 0.0 108.074 175.534 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -97.61 150.58 20.98 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -172.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -142.51 146.49 34.75 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 114.633 -1.167 . . . . 0.0 109.926 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.513 ' O ' ' HA ' ' A' ' 63' ' ' SER . 8.7 mm -77.44 126.71 38.13 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 C-N-CA 124.084 0.954 . . . . 0.0 108.585 177.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.2 t -154.36 96.47 1.92 Allowed 'General case' 0 N--CA 1.423 -1.781 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.437 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . 102.72 -144.18 16.03 Favored Glycine 0 N--CA 1.426 -1.969 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -102.85 22.36 13.94 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 174.182 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -129.91 169.69 14.88 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 114.171 -1.377 . . . . 0.0 107.81 -174.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 20.9 t -111.86 141.01 28.62 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.13 0 N-CA-C 104.864 -2.272 . . . . 0.0 104.864 172.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.1 p -128.89 171.69 12.05 Favored 'General case' 0 C--N 1.277 -2.58 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 18.8 p90 -149.07 139.85 22.76 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 118.739 0.7 . . . . 0.0 112.257 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -147.27 -176.88 5.4 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.335 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.5 m -72.93 125.48 27.67 Favored 'General case' 0 C--N 1.296 -1.739 0 O-C-N 123.378 0.424 . . . . 0.0 110.328 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 77.4 m -47.03 -23.27 0.44 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 126.803 2.041 . . . . 0.0 114.312 -177.692 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -83.03 -1.17 51.98 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.83 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.9 p -80.37 154.33 27.79 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 119.946 -0.701 . . . . 0.0 109.674 172.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -94.41 106.21 18.19 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -175.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -137.51 173.97 11.1 Favored 'General case' 0 C--O 1.204 -1.325 0 C-N-CA 123.179 0.592 . . . . 0.0 110.13 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.709 ' HB3' ' O ' ' A' ' 21' ' ' SER . 3.6 mpt_? -81.95 175.51 10.32 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 -177.763 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 18.9 p90 -149.77 165.81 31.33 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.642 1.11 . . . . 0.0 111.939 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.482 HD13 HD12 ' A' ' 53' ' ' LEU . 70.1 mt -124.61 124.88 69.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.356 0.598 . . . . 0.0 110.892 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 95.8 m -102.61 144.2 31.32 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.41 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.419 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 5.7 pt20 -127.48 139.55 52.73 Favored 'General case' 0 N--CA 1.42 -1.95 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 171.764 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.6 ttmm -110.64 118.25 35.7 Favored 'General case' 0 C--N 1.254 -3.567 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -69.79 118.34 12.52 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 175.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.644 HD13 ' SG ' ' A' ' 17' ' ' CYS . 12.8 tp . . . . . 0 C--N 1.295 -1.793 0 CA-C-N 114.157 -1.383 . . . . 0.0 109.715 -172.117 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.467 HD13 ' HB3' ' A' ' 126' ' ' LEU . 4.4 mp . . . . . 0 N--CA 1.441 -0.885 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -87.8 142.92 27.44 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 69.3 m -108.3 162.85 18.45 Favored Pre-proline 0 C--O 1.25 1.087 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.77 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.86 164.81 25.67 Favored 'Trans proline' 0 C--N 1.366 1.481 0 C-N-CA 122.493 2.129 . . . . 0.0 112.584 173.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -56.36 -21.51 25.15 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 125.481 1.512 . . . . 0.0 114.669 -175.478 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -85.17 -11.49 54.91 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 120.949 0.404 . . . . 0.0 110.411 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 37.4 m95 -113.34 158.93 19.96 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -165.618 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -99.38 175.96 5.68 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 169.16 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.7 p -139.9 132.39 28.6 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 118.8 0.727 . . . . 0.0 111.34 -179.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' HIS . . . . . 0.469 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 42.8 t-80 -149.57 124.09 9.71 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 122.188 -0.32 . . . . 0.0 111.041 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.51 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 3.0 mmp_? 66.71 -72.58 0.08 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.07 1.348 . . . . 0.0 113.22 175.561 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -158.98 21.37 0.2 Allowed 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 122.79 0.436 . . . . 0.0 110.511 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LYS . . . . . 0.526 ' HG2' ' NE2' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -145.01 148.1 33.36 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.518 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 17' ' ' CYS . . . . . 0.555 ' O ' ' HA ' ' A' ' 123' ' ' GLN . 8.9 m -95.87 146.58 24.45 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 175.472 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' PHE . . . . . 0.469 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 22.3 m-85 -117.9 143.12 46.61 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 118.624 0.647 . . . . 0.0 110.522 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -132.25 107.99 8.94 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 69.0 t -89.67 96.03 5.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.753 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 5.0 m -78.08 108.29 11.26 Favored 'General case' 0 N--CA 1.423 -1.786 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -80.09 14.75 1.74 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.437 0.637 . . . . 0.0 112.201 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.51 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 6.0 m -103.13 150.06 6.92 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.881 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.4 m -106.01 141.55 37.2 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -172.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -154.16 174.39 14.8 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 127.906 2.483 . . . . 0.0 107.061 -176.009 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 114' ' ' CYS . 60.0 p -84.55 163.96 19.04 Favored 'General case' 0 C--O 1.255 1.366 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 169.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.9 t90 -53.19 -46.6 69.07 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.139 0.495 . . . . 0.0 111.852 -177.509 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -64.07 -37.26 86.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.928 -176.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -68.33 -45.44 72.9 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.659 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.92 -34.84 89.08 Favored Glycine 0 CA--C 1.506 -0.502 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.496 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 tt -56.34 -50.99 69.9 Favored 'General case' 0 C--O 1.25 1.092 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 175.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.36 -38.95 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.958 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.47 -40.05 77.71 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 64.6 m -66.26 -39.68 89.63 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.57 -29.26 70.45 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 120.992 0.425 . . . . 0.0 110.838 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.94 -16.59 78.31 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.247 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -92.47 -11.16 35.39 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 177.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.2 31.12 29.14 Favored Glycine 0 N--CA 1.444 -0.825 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 -171.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -129.81 176.98 7.59 Favored 'General case' 0 N--CA 1.42 -1.929 0 CA-C-N 114.755 -0.723 . . . . 0.0 110.096 -174.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' THR . . . . . 0.485 ' HB ' HD11 ' A' ' 80' ' ' ILE . 2.9 p -115.3 157.85 23.21 Favored 'General case' 0 C--N 1.282 -2.329 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.891 178.614 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.9 tp -66.47 140.68 58.03 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 173.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' MET . . . . . 0.431 ' HE3' ' HA ' ' A' ' 44' ' ' ILE . 16.3 tpt -39.31 120.75 1.07 Allowed 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -171.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.1 tp -121.04 90.52 3.34 Favored 'General case' 0 N--CA 1.434 -1.265 0 N-CA-C 106.427 -1.694 . . . . 0.0 106.427 -175.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ILE . . . . . 0.482 HD13 HD11 ' A' ' 50' ' ' LEU . 44.4 mt -67.61 122.74 19.34 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.019 -171.639 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -92.9 -21.85 19.59 Favored 'General case' 0 CA--C 1.552 1.058 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.984 -176.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ASP . . . . . 0.58 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 28.3 t70 -173.08 177.64 2.69 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -171.09 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -78.65 -31.06 46.67 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.576 -0.702 . . . . 0.0 111.274 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.415 ' HB2' ' OD2' ' A' ' 46' ' ' ASP . 0.7 OUTLIER -58.37 -30.23 66.62 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 124.052 0.941 . . . . 0.0 108.59 176.291 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLU . . . . . 0.58 ' HB2' ' O ' ' A' ' 46' ' ' ASP . 4.3 mm-40 -61.24 -56.27 22.52 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.429 174.636 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.603 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 79.5 mt -69.58 -28.47 66.0 Favored 'General case' 0 CA--C 1.48 -1.716 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -175.032 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.4 ptt180 -69.97 -34.19 73.05 Favored 'General case' 0 N--CA 1.421 -1.905 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.147 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -73.77 -28.28 61.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 175.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.65 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.0 mm? -61.47 -49.36 77.09 Favored 'General case' 0 C--O 1.182 -2.468 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 173.324 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 37.9 mt -55.35 -35.4 65.18 Favored 'General case' 0 C--N 1.313 -0.996 0 O-C-N 123.236 0.335 . . . . 0.0 111.351 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -68.12 -42.59 79.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.073 176.339 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.2 p -79.51 -24.52 42.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -178.239 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 53' ' ' LEU . 36.4 mm -65.84 -51.36 62.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 174.541 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 49.6 tptt 72.6 -65.67 0.34 Allowed 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.06 0.944 . . . . 0.0 113.472 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -65.06 -55.32 19.55 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 118.633 0.652 . . . . 0.0 112.429 -176.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.555 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 44.5 mtmt 69.44 21.34 6.9 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.429 0.692 . . . . 0.0 110.369 -177.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -120.17 19.7 12.17 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.272 0.558 . . . . 0.0 110.852 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASN . . . . . 0.538 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 27.5 m120 -124.47 -153.8 0.58 Allowed 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' SER . . . . . 0.58 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 5.6 t -149.8 126.97 11.31 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 175.715 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' PHE . . . . . 0.538 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.1 m-85 -129.57 113.37 14.74 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -175.16 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -57.63 136.76 56.84 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 124.085 0.954 . . . . 0.0 112.29 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -120.68 176.71 3.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 170.629 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLY . . . . . 0.593 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -78.19 56.63 4.02 Favored Glycine 0 C--O 1.204 -1.775 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.814 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.7 mt -125.03 121.07 33.3 Favored 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 122.998 0.519 . . . . 0.0 111.718 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 30.0 ptt180 -128.3 135.42 49.59 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.084 176.845 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -81.33 113.5 19.48 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.4 p . . . . . 0 C--N 1.3 -1.583 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.848 -174.002 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 17.2 m120 . . . . . 0 N--CA 1.431 -1.387 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -100.82 122.42 43.4 Favored 'General case' 0 C--N 1.288 -2.074 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -116.82 147.2 42.33 Favored 'General case' 0 C--N 1.291 -1.964 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.183 178.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' TRP . . . . . 0.593 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 16.1 m95 -91.0 178.14 6.09 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 123.951 0.782 . . . . 0.0 109.504 -177.621 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.485 HD11 ' HB ' ' A' ' 40' ' ' THR . 48.6 pt -73.06 -12.46 15.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.028 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ASN . . . . . 0.478 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 31.5 p-10 -95.55 -0.91 51.52 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.802 0.81 . . . . 0.0 109.021 178.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.1 5.58 76.51 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 114.5 -1.227 . . . . 0.0 113.563 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.9 t -81.83 169.4 16.92 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -178.993 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.2 m -100.04 142.9 30.9 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LEU . . . . . 0.544 HD11 HD12 ' A' ' 92' ' ' ILE . 36.9 tp -54.57 138.87 39.88 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 124.63 1.172 . . . . 0.0 113.233 176.158 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ASN . . . . . 0.468 ' OD1' HG13 ' A' ' 89' ' ' VAL . 25.9 t-20 -93.57 86.52 5.22 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 170.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 p -73.08 3.83 5.05 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -77.57 -21.78 51.97 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.463 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.468 HG13 ' OD1' ' A' ' 86' ' ' ASN . 32.9 m -78.56 -55.24 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 C-N-CA 120.156 -0.617 . . . . 0.0 112.367 -178.463 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' LEU . . . . . 0.426 HD12 HD13 ' A' ' 50' ' ' LEU . 94.4 mt -140.29 170.37 15.95 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -175.827 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.415 ' O ' HG12 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -72.97 123.19 23.0 Favored 'General case' 0 CA--C 1.5 -0.963 0 O-C-N 123.876 0.735 . . . . 0.0 112.632 -175.828 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ILE . . . . . 0.544 HD12 HD11 ' A' ' 85' ' ' LEU . 2.4 mt -152.32 99.47 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 N-CA-C 104.733 -2.321 . . . . 0.0 104.733 174.202 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 5.3 m -66.8 136.69 55.84 Favored 'General case' 0 C--N 1.285 -2.21 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.553 -173.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -102.0 26.34 24.68 Favored Glycine 0 CA--C 1.479 -2.203 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -175.025 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -152.44 130.63 11.96 Favored 'General case' 0 N--CA 1.409 -2.515 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 174.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.4 t -169.93 -31.62 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.596 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 65.81 28.54 10.84 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.448 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -105.57 178.63 4.51 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.877 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -96.81 27.75 3.8 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.0 p -63.31 150.35 43.49 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 113.004 -1.907 . . . . 0.0 115.797 -171.93 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -134.03 147.53 50.97 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 113.444 -1.707 . . . . 0.0 106.688 173.686 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.48 151.56 19.27 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -172.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -146.71 147.37 30.9 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.849 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' ILE . . . . . 0.58 ' O ' ' HA ' ' A' ' 63' ' ' SER . 11.5 mm -76.95 131.06 35.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 107.397 -1.335 . . . . 0.0 107.397 177.569 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 27.9 t -106.68 -71.23 0.76 Allowed 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 175.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 106' ' ' GLY . . . . . 0.555 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . -124.98 -102.22 1.39 Allowed Glycine 0 N--CA 1.413 -2.893 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 178.369 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -98.64 2.47 47.29 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -125.51 162.74 24.22 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.034 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 109' ' ' VAL . . . . . 0.427 ' HB ' HG12 ' A' ' 92' ' ' ILE . 3.8 t -99.37 136.82 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.419 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 174.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.3 p -125.39 166.47 16.51 Favored 'General case' 0 C--N 1.269 -2.917 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.8 p90 -138.85 134.15 32.94 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 118.927 0.785 . . . . 0.0 112.848 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -132.24 179.58 6.03 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.491 -1.231 . . . . 0.0 108.406 -176.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.4 m -78.31 129.22 34.77 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 174.022 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' CYS . . . . . 0.404 ' O ' ' HB ' ' A' ' 26' ' ' THR . 76.6 m -48.21 -18.94 0.24 Allowed 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 126.591 1.956 . . . . 0.0 115.038 -176.543 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -86.37 -3.99 59.09 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 123.525 0.73 . . . . 0.0 110.559 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.0 p -77.43 149.59 35.1 Favored 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 119.965 -0.694 . . . . 0.0 111.069 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -86.39 93.8 9.21 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.989 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -128.35 174.45 9.3 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 114.804 -1.089 . . . . 0.0 108.523 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ARG . . . . . 0.753 ' HB3' ' O ' ' A' ' 21' ' ' SER . 2.5 mpt_? -93.37 -174.5 3.53 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 -177.668 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 120' ' ' TRP . . . . . 0.425 ' CH2' HG23 ' A' ' 23' ' ' VAL . 28.8 p90 -152.21 167.56 28.19 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.864 1.211 . . . . 0.0 111.95 -179.338 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 69.9 mt -125.59 129.85 72.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.451 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 75.0 m -110.03 150.98 27.75 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 123' ' ' GLN . . . . . 0.555 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.3 pt20 -128.25 140.64 51.78 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 171.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -117.27 115.16 24.74 Favored 'General case' 0 C--N 1.277 -2.556 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -74.95 120.69 20.82 Favored 'General case' 0 C--N 1.286 -2.156 0 CA-C-O 121.362 0.601 . . . . 0.0 111.803 -174.24 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' LEU . . . . . 0.467 ' HB3' HD13 ' A' ' 4' ' ' LEU . 2.8 mm? . . . . . 0 CA--C 1.504 -0.814 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.075 179.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.559 ' HB2' ' OD1' ' A' ' 15' ' ' ASP . 14.1 m . . . . . 0 N--CA 1.441 -0.899 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.97 7.69 39.1 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -173.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.41 ' HE3' ' CB ' ' A' ' 12' ' ' SER 0.251 6.3 tmtt? 69.25 139.31 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 179.626 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.526 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 6.0 mp -97.3 175.85 6.12 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 176.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -79.49 143.38 34.96 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -174.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.671 ' SG ' ' HD2' ' A' ' 7' ' ' PRO . 49.0 t -137.37 156.2 75.27 Favored Pre-proline 0 C--N 1.306 -1.293 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.671 ' HD2' ' SG ' ' A' ' 6' ' ' CYS . 81.7 Cg_exo -48.78 153.22 3.79 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 122.843 2.362 . . . . 0.0 112.814 176.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -59.95 -29.37 68.37 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -171.077 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -78.43 -10.84 59.86 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.295 0.569 . . . . 0.0 111.226 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.476 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 26.9 m95 -95.63 117.03 29.71 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.041 -173.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.421 ' H ' HD22 ' A' ' 11' ' ' LEU . 1.3 mm? -72.72 122.04 20.83 Favored 'General case' 0 CA--C 1.497 -1.066 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -176.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.41 ' CB ' ' HE3' ' A' ' 3' ' ' LYS . 11.0 p -92.7 128.52 38.58 Favored 'General case' 0 N--CA 1.41 -2.428 0 CA-C-O 122.355 1.074 . . . . 0.0 113.556 -174.014 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 25.5 t60 -138.41 154.78 48.9 Favored 'General case' 0 C--O 1.2 -1.531 0 C-N-CA 126.973 2.109 . . . . 0.0 105.839 -177.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -11.89 83.98 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.998 0 C-N-CA 125.78 1.632 . . . . 0.0 114.586 175.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.559 ' OD1' ' HB2' ' A' ' 1' ' ' SER . 18.9 m-20 60.74 23.53 13.42 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.801 1.641 . . . . 0.0 114.617 173.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.593 ' HE2' ' OE1' ' A' ' 49' ' ' GLU . 13.0 mtpp -148.86 142.58 25.56 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.859 ' SG ' ' HB3' ' A' ' 124' ' ' LYS . 19.4 p -123.9 139.28 54.11 Favored 'General case' 0 C--N 1.287 -2.116 0 O-C-N 121.511 -0.743 . . . . 0.0 109.807 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.448 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 17.5 m-85 -116.87 140.51 49.37 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -171.261 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -115.56 106.64 14.16 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.1 t -87.42 92.47 3.81 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.77 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.1 m -77.26 114.56 16.2 Favored 'General case' 0 N--CA 1.423 -1.804 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.354 -176.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.554 ' C ' ' HG2' ' A' ' 119' ' ' ARG . 61.1 mm-40 -83.86 13.92 4.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.755 0.822 . . . . 0.0 112.663 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.8 m -109.63 150.09 12.43 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 178.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.0 m -98.24 152.8 19.01 Favored 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -173.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.9 m-20 -154.43 -176.92 6.12 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 127.506 2.322 . . . . 0.0 106.687 178.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 61.3 p -91.81 168.34 11.52 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 168.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 92.0 t90 -58.35 -53.83 53.87 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.593 0.633 . . . . 0.0 112.289 -175.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.492 ' O ' HG23 ' A' ' 32' ' ' VAL . 42.9 mt-10 -64.93 -31.93 73.41 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.307 0.575 . . . . 0.0 110.416 -177.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -71.45 -42.15 68.56 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.124 -0.943 . . . . 0.0 110.594 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.57 -33.88 87.51 Favored Glycine 0 CA--C 1.501 -0.843 0 N-CA-C 110.859 -0.896 . . . . 0.0 110.859 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 tt -59.91 -46.86 88.01 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 176.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 28' ' ' GLU . 90.1 t -61.87 -36.68 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.274 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -61.26 -36.76 80.9 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.845 175.752 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.0 m -71.51 -40.07 70.38 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -55.98 -39.7 72.2 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -56.17 -34.41 62.54 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 114.943 -1.026 . . . . 0.0 114.434 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -89.76 -5.3 57.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.51 0.655 . . . . 0.0 111.507 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.06 51.91 5.98 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 107.753 -2.139 . . . . 0.0 107.753 -171.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.01 178.04 8.5 Favored 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.2 p -123.14 158.48 30.62 Favored 'General case' 0 C--N 1.281 -2.409 0 C-N-CA 122.765 0.426 . . . . 0.0 110.936 -177.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.1 tp -76.15 130.48 38.33 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 174.507 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.2 tpt -30.03 120.53 0.17 Allowed 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 117.264 2.32 . . . . 0.0 117.264 -169.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.444 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 3.1 mm? -109.1 110.95 22.32 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 124.704 1.201 . . . . 0.0 108.007 177.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.515 HD13 HD21 ' A' ' 50' ' ' LEU . 37.8 mt -98.68 132.84 43.1 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -175.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.488 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 56.0 tp60 -105.84 -44.27 4.67 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 120.868 0.365 . . . . 0.0 111.464 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -137.57 178.13 7.34 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -172.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -81.04 -19.42 43.88 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 122.049 -0.407 . . . . 0.0 110.362 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 51.9 mt-10 -57.91 -33.23 68.54 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.699 0.762 . . . . 0.0 109.788 173.495 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.593 ' OE1' ' HE2' ' A' ' 16' ' ' LYS . 10.2 mm-40 -64.89 -55.36 19.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.671 -1.15 . . . . 0.0 107.995 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.515 HD21 HD13 ' A' ' 44' ' ' ILE . 63.4 mt -68.96 -25.15 64.4 Favored 'General case' 0 CA--C 1.496 -1.13 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -176.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.509 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 34.7 ptt180 -68.93 -33.73 74.21 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.363 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -73.72 -28.21 61.59 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.669 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.4 mm? -63.75 -48.83 75.4 Favored 'General case' 0 C--O 1.176 -2.805 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.48 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 43.7 mt -54.76 -34.11 62.15 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -67.35 -46.74 72.51 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.953 0.406 . . . . 0.0 111.444 172.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.8 p -81.17 -20.88 40.27 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -174.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.669 HG12 ' O ' ' A' ' 53' ' ' LEU . 16.6 mm -56.24 -45.97 81.27 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 C-N-CA 123.817 0.847 . . . . 0.0 111.031 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? 69.86 -63.69 0.38 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.024 0.929 . . . . 0.0 112.798 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.87 -56.34 6.5 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -175.306 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.418 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 91.4 mttt 74.06 -38.57 0.4 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.175 0.99 . . . . 0.0 113.669 -176.486 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -82.3 28.85 0.44 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.879 0.847 . . . . 0.0 111.707 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -132.6 -173.99 3.33 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.026 177.167 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.607 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 13.3 m -137.63 133.09 33.93 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.483 ' CE2' HD12 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -131.47 118.62 20.44 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -175.556 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -59.99 135.95 57.87 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 123.357 0.663 . . . . 0.0 112.038 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.59 176.21 2.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 N-CA-C 106.6 -1.629 . . . . 0.0 106.6 169.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.558 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.28 40.44 1.73 Allowed Glycine 0 C--O 1.22 -0.763 0 CA-C-N 118.89 0.768 . . . . 0.0 114.59 -174.093 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.558 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 20.5 mt -101.93 115.51 30.7 Favored 'General case' 0 CA--C 1.488 -1.422 0 C-N-CA 123.191 0.596 . . . . 0.0 111.637 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 28.4 ptt180 -122.02 137.22 54.88 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.104 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -91.11 113.69 26.02 Favored 'General case' 0 C--N 1.287 -2.137 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.451 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 22.7 p -94.83 116.88 29.27 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -174.129 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.412 HD23 ' H ' ' A' ' 75' ' ' MET . 50.5 mt -119.97 144.02 36.61 Favored Pre-proline 0 C--N 1.309 -1.16 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.168 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -85.7 126.76 9.86 Favored 'Cis proline' 0 N--CA 1.446 -1.312 0 C-N-CA 123.493 -1.461 . . . . 0.0 111.78 -0.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.451 ' HB3' ' O ' ' A' ' 71' ' ' THR . 13.4 t70 175.77 -42.87 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 124.113 0.965 . . . . 0.0 109.155 -174.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.412 ' H ' HD23 ' A' ' 72' ' ' LEU . 45.4 mtm 71.49 11.83 6.55 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 176.061 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -106.14 154.88 20.05 Favored 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.052 172.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -88.92 125.72 35.07 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.371 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -118.9 158.84 24.91 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.121 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.558 ' CZ3' ' HG ' ' A' ' 68' ' ' LEU . 62.4 m95 -96.19 176.32 6.12 Favored 'General case' 0 C--N 1.277 -2.572 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.185 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.4 pt -73.36 -23.34 19.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 CA-C-O 121.01 0.433 . . . . 0.0 111.362 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.416 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 29.6 p-10 -83.3 -16.32 46.68 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.3 8.49 35.64 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.435 -0.802 . . . . 0.0 113.081 175.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.8 m -75.65 170.52 16.01 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 175.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 20.7 m -102.54 139.68 37.82 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.533 HD13 HD21 ' A' ' 68' ' ' LEU . 42.0 tp -62.98 142.36 58.39 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 176.741 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -95.7 86.8 4.5 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.6 p -71.09 -8.23 52.02 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -176.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -77.94 -14.12 59.64 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 27.7 m -75.76 -49.66 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.828 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.0 mt -147.69 -179.01 6.57 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 -173.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 99.87 1.74 Allowed 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.041 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.48 HD12 HD11 ' A' ' 85' ' ' LEU . 8.0 mt -140.51 96.67 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 172.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.3 m -62.24 124.67 21.48 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.884 -178.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -85.69 -41.49 7.24 Favored Glycine 0 N--CA 1.41 -3.059 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -94.29 88.37 5.54 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-O 121.82 0.819 . . . . 0.0 110.971 178.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.8 t -126.39 -32.43 2.68 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.536 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 60.83 36.99 18.91 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.303 0.641 . . . . 0.0 111.383 176.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -116.99 177.82 4.57 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -81.58 27.69 0.43 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 126.167 1.787 . . . . 0.0 109.372 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.411 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 13.9 m -72.85 142.62 47.97 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -170.033 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 61.6 m -133.06 146.28 51.54 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 103.944 -2.613 . . . . 0.0 103.944 166.075 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -99.81 153.14 19.37 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -172.193 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.29 148.43 36.33 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.61 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.607 ' O ' ' HA ' ' A' ' 63' ' ' SER . 11.0 mm -78.13 128.4 38.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.483 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 175.02 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.1 t -140.42 90.17 2.34 Favored 'General case' 0 N--CA 1.408 -2.529 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.418 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . 89.0 -126.65 8.3 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.25 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -101.86 8.55 41.23 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 176.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -119.13 167.21 12.02 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.814 -175.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 14.2 t -115.75 134.24 59.63 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 N-CA-C 104.682 -2.34 . . . . 0.0 104.682 173.265 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 69.7 p -124.97 170.07 11.48 Favored 'General case' 0 C--N 1.267 -2.988 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.411 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 25.4 p90 -148.46 142.04 25.45 Favored 'General case' 0 C--N 1.298 -1.666 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.421 -178.781 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -154.69 178.69 9.83 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.815 -176.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 29.3 m -54.07 124.53 15.9 Favored 'General case' 0 N--CA 1.443 -0.817 0 O-C-N 124.132 0.895 . . . . 0.0 108.992 176.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 8.4 m -53.57 -22.88 9.27 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.491 1.117 . . . . 0.0 112.635 -174.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -80.43 -2.06 44.15 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.09 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 24.9 p -74.47 136.58 42.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 119.236 0.925 . . . . 0.0 112.608 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.79 101.42 0.26 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.328 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' ASN . . . . . 0.531 ' OD1' ' HB2' ' A' ' 63' ' ' SER . 47.3 m-80 -142.58 158.98 43.1 Favored 'General case' 0 CA--C 1.485 -1.539 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.209 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.77 ' HB3' ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.57 178.68 6.49 Favored 'General case' 0 C--N 1.292 -1.925 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.093 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 18.4 p90 -152.36 167.14 29.65 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 118.733 -1.187 . . . . 0.0 112.36 -174.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.507 HD13 HD12 ' A' ' 53' ' ' LEU . 82.6 mt -125.29 118.28 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 CA-C-O 121.625 0.726 . . . . 0.0 110.712 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 90.7 m -97.02 140.87 30.89 Favored 'General case' 0 C--N 1.287 -2.135 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.758 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 123' ' ' GLN . 5.0 pt20 -120.12 137.86 53.91 Favored 'General case' 0 N--CA 1.415 -2.213 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 173.553 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.859 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 22.8 ttmm -110.95 110.91 21.69 Favored 'General case' 0 C--N 1.258 -3.374 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 171.113 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -83.54 124.0 30.31 Favored 'General case' 0 N--CA 1.406 -2.63 0 C-N-CA 119.621 -0.832 . . . . 0.0 108.767 -175.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.526 ' HG ' ' H ' ' A' ' 4' ' ' LEU . 1.8 mm? -68.2 -21.12 64.88 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.255 -177.117 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' TYR . . . . . 0.466 ' HD1' ' HB3' ' A' ' 15' ' ' ASP . 32.6 m-85 -111.88 85.54 2.16 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.125 173.219 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 8.9 p-80 -109.48 -10.05 14.9 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.93 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -99.06 17.62 19.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.783 177.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 2.6 m -61.14 -70.2 0.2 Allowed 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 123.16 0.584 . . . . 0.0 111.116 -177.472 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.1 mt -130.55 105.52 7.9 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.9 m -87.75 -40.88 13.72 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 176.657 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 29.5 m120 68.52 155.71 0.12 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.947 177.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 65.94 163.28 0.16 Allowed 'General case' 0 C--O 1.242 0.687 0 C-N-CA 125.287 1.435 . . . . 0.0 113.541 175.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 22.3 t -115.55 23.14 5.48 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.273 0 N-CA-C 104.914 -2.254 . . . . 0.0 104.914 172.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 117.54 -82.28 0.33 Allowed Glycine 0 N--CA 1.422 -2.283 0 N-CA-C 108.315 -1.914 . . . . 0.0 108.315 -173.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -143.08 -55.25 0.41 Allowed 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 145.6 56.45 0.02 OUTLIER Glycine 0 N--CA 1.427 -1.934 0 N-CA-C 109.971 -1.251 . . . . 0.0 109.971 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 75.8 t60 . . . . . 0 C--N 1.308 -1.198 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.215 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 C--O 1.245 0.855 0 CA-C-O 120.866 0.365 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.92 91.4 5.99 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -78.32 165.82 23.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.322 0.582 . . . . 0.0 111.871 -178.398 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.447 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 4.7 mp -97.91 -160.51 0.81 Allowed 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 114.926 -1.034 . . . . 0.0 108.614 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -94.38 135.05 36.24 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.577 -176.557 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.494 ' HB3' HD11 ' A' ' 126' ' ' LEU . 8.8 p -128.58 166.41 24.76 Favored Pre-proline 0 C--N 1.296 -1.738 0 C-N-CA 124.089 0.956 . . . . 0.0 108.501 177.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -61.42 156.91 43.66 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 121.641 1.561 . . . . 0.0 113.155 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -42.64 -48.64 5.51 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 116.299 1.963 . . . . 0.0 116.299 -175.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -83.76 7.15 18.68 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -172.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.521 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 60.1 m95 -104.4 121.45 43.42 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 121.232 0.539 . . . . 0.0 110.711 -177.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.534 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 4.8 mp -75.92 106.51 7.54 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 124.843 1.257 . . . . 0.0 111.063 -176.349 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.1 p -74.66 114.44 13.08 Favored 'General case' 0 C--N 1.276 -2.625 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.794 -176.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -138.93 125.72 20.9 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 123.999 0.919 . . . . 0.0 109.413 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.464 ' O ' ' HB3' ' A' ' 3' ' ' LYS . 72.3 mtt180 57.93 -88.61 0.02 OUTLIER 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.57 ' HB2' ' CD1' ' A' ' 127' ' ' TYR . 10.0 p-10 -144.69 25.31 1.48 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.499 0.666 . . . . 0.0 110.112 -177.024 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.36 151.7 36.96 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 178.703 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.636 ' SG ' HD21 ' A' ' 126' ' ' LEU . 80.8 m -116.34 140.36 49.42 Favored 'General case' 0 C--N 1.275 -2.631 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.057 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -110.82 141.67 43.86 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.206 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -119.24 108.17 14.31 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 173.757 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.0 t -89.18 95.05 5.13 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.69 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.8 m -77.97 115.19 17.52 Favored 'General case' 0 N--CA 1.417 -2.085 0 CA-C-N 115.328 -0.851 . . . . 0.0 108.725 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 79.4 mm-40 -87.82 13.75 10.08 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.956 0.902 . . . . 0.0 111.255 -178.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.8 m -107.65 156.48 8.12 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 37.7 m -91.77 156.74 17.33 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -173.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.1 m-20 -170.88 170.75 6.28 Favored 'General case' 0 CA--C 1.502 -0.876 0 C-N-CA 127.414 2.286 . . . . 0.0 107.912 175.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.5 p -85.02 166.02 17.06 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 172.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.534 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 88.9 t90 -56.48 -53.26 59.54 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -174.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.461 ' O ' HG23 ' A' ' 32' ' ' VAL . 37.9 mt-10 -63.92 -32.29 73.77 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.942 0.877 . . . . 0.0 110.556 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -73.91 -44.28 55.68 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.46 -1.245 . . . . 0.0 110.412 -175.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.12 -34.63 90.49 Favored Glycine 0 C--O 1.221 -0.682 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 174.504 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 tt -58.86 -51.17 71.14 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 28' ' ' GLU . 87.6 t -59.3 -38.21 73.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.502 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.89 -36.64 84.59 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.98 -0.555 . . . . 0.0 112.103 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 81.3 m -66.34 -43.47 86.02 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -57.23 -29.88 64.13 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.577 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -56.92 -34.91 66.33 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.933 179.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -101.44 11.57 38.89 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.78 14.07 82.93 Favored Glycine 0 C--O 1.245 0.794 0 CA-C-O 121.625 0.57 . . . . 0.0 111.763 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -104.69 166.16 10.58 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -175.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.429 ' HB ' HD11 ' A' ' 80' ' ' ILE . 3.2 p -110.01 160.57 16.32 Favored 'General case' 0 C--N 1.28 -2.441 0 O-C-N 122.175 -0.328 . . . . 0.0 110.626 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -75.52 124.69 27.61 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.3 tpt -24.72 120.09 0.05 Allowed 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 -170.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -110.55 105.45 14.39 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 124.845 1.258 . . . . 0.0 107.62 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.517 HD13 HD11 ' A' ' 50' ' ' LEU . 34.2 mt -86.22 105.81 15.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -176.162 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -90.27 -22.69 21.47 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.731 -176.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.545 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 15.9 t70 -149.64 163.9 36.63 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -170.614 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -35.22 80.32 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 176.253 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -60.56 -27.83 67.97 Favored 'General case' 0 CA--C 1.499 -0.983 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.545 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 13.3 mm-40 -57.54 -55.79 30.26 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.652 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 61.6 mt -71.88 -25.78 62.07 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -177.508 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -62.88 -38.01 89.2 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -68.06 -37.0 80.79 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.692 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.5 mm? -62.48 -53.17 58.81 Favored 'General case' 0 C--O 1.206 -1.193 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.652 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 60.3 mt -56.49 -34.59 67.1 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -177.14 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -73.56 -41.91 62.32 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 176.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.3 p -81.4 -34.98 31.26 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.692 HG12 ' O ' ' A' ' 53' ' ' LEU . 51.0 mm -57.12 -45.73 84.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 CA-C-O 121.244 0.545 . . . . 0.0 109.655 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 52.0 tptt 68.96 -56.79 0.53 Allowed 'General case' 0 C--O 1.24 0.588 0 C-N-CA 124.895 1.278 . . . . 0.0 112.858 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -62.26 -52.18 64.75 Favored 'General case' 0 C--O 1.207 -1.156 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.61 ' H ' HG22 ' A' ' 57' ' ' ILE . 97.6 mttt 73.86 -47.98 0.66 Allowed 'General case' 0 C--O 1.205 -1.27 0 C-N-CA 124.98 1.312 . . . . 0.0 112.712 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -70.21 27.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.168 1.387 . . . . 0.0 114.058 -174.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.564 ' O ' ' HA ' ' A' ' 105' ' ' SER . 77.6 m-20 -115.29 -171.18 1.91 Allowed 'General case' 0 C--N 1.286 -2.186 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 176.345 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.657 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 14.0 m -144.82 119.3 9.67 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.532 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.5 m-85 -124.33 123.47 40.27 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -176.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.533 ' CE2' ' HB2' ' A' ' 118' ' ' ASN . 78.0 m95 -62.17 138.86 58.47 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 123.182 0.593 . . . . 0.0 110.616 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -118.45 174.67 4.11 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 169.371 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.619 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.41 47.52 2.39 Favored Glycine 0 C--O 1.21 -1.386 0 CA-C-N 118.728 0.695 . . . . 0.0 114.817 -173.805 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.494 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 17.3 mt -113.4 120.01 39.61 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 123.451 0.701 . . . . 0.0 111.901 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -126.4 140.38 52.53 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.291 176.565 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -91.06 124.5 35.34 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.448 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 35.5 p -105.97 117.86 35.11 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -175.397 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 57.6 mt -120.51 143.72 36.78 Favored Pre-proline 0 N--CA 1.439 -0.977 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 174.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.54 126.62 11.24 Favored 'Cis proline' 0 C--O 1.243 0.772 0 C-N-CA 123.365 -1.515 . . . . 0.0 110.92 -4.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.448 ' HB3' ' O ' ' A' ' 71' ' ' THR . 12.9 t70 -177.7 -39.12 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 -176.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 4.6 mpp? 67.15 16.33 10.21 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.568 1.547 . . . . 0.0 114.488 176.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -118.37 159.74 22.9 Favored 'General case' 0 C--O 1.258 1.509 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.114 173.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 66.8 m95 -97.41 134.41 40.71 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -126.79 151.97 47.55 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.683 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.619 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 37.0 m95 -93.63 169.93 9.96 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.429 HD11 ' HB ' ' A' ' 40' ' ' THR . 38.6 pt -69.38 -20.42 24.13 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -177.046 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.4 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 31.3 p-10 -85.05 -14.14 48.24 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.655 0.741 . . . . 0.0 109.286 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.98 8.41 36.55 Favored Glycine 0 N--CA 1.443 -0.894 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.363 176.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.8 m -74.97 163.42 27.64 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.032 0.444 . . . . 0.0 111.692 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 19.9 m -98.96 140.4 33.16 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 176.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.574 HD11 HD12 ' A' ' 92' ' ' ILE . 43.5 tp -54.64 143.86 23.57 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -100.87 95.73 6.82 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 170.149 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.0 m -71.39 -11.28 60.81 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.123 0.487 . . . . 0.0 111.814 -175.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -78.14 -12.49 60.0 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -176.325 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 29.2 m -75.3 -54.2 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 C-N-CA 119.079 -1.048 . . . . 0.0 112.473 -177.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.5 mt -152.03 -178.29 6.68 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -177.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -68.33 111.88 4.87 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -176.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.574 HD12 HD11 ' A' ' 85' ' ' LEU . 9.7 mt -145.97 105.44 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 174.314 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.0 m -61.06 128.99 39.16 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 123.021 0.529 . . . . 0.0 109.899 -179.169 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -84.33 -53.33 3.3 Favored Glycine 0 N--CA 1.418 -2.516 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 -176.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -93.23 82.56 4.53 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-O 122.767 1.27 . . . . 0.0 110.536 176.354 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.6 t -100.69 -24.01 14.51 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.587 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 63.46 17.63 10.47 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.609 0.764 . . . . 0.0 112.218 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -111.32 -178.68 3.51 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -86.67 26.93 1.03 Allowed 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 126.654 1.982 . . . . 0.0 109.798 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 m -72.1 150.72 43.63 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 116.619 2.081 . . . . 0.0 116.619 -170.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -143.45 148.78 36.63 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 166.562 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -98.09 153.81 18.17 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -169.072 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.25 150.2 38.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.376 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.657 ' O ' ' HA ' ' A' ' 63' ' ' SER . 17.5 mm -77.82 112.11 15.41 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.532 0 N-CA-C 106.627 -1.619 . . . . 0.0 106.627 173.205 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.564 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 8.8 t -134.04 100.6 4.77 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 98.62 -134.43 11.69 Favored Glycine 0 C--N 1.276 -2.79 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -100.15 0.98 41.63 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -128.77 -176.66 3.91 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.315 -172.162 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.2 t -105.88 135.41 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.548 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 71.2 p -131.32 175.08 9.43 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 106.406 -1.701 . . . . 0.0 106.406 176.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -146.5 156.91 43.61 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 119.94 1.245 . . . . 0.0 113.307 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -161.3 -176.38 5.37 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.362 1.065 . . . . 0.0 109.67 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 17.5 t -68.66 128.38 36.42 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 176.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.534 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 79.5 m -50.62 -12.93 0.11 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 126.045 1.738 . . . . 0.0 115.202 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -100.97 3.66 41.81 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.279 -168.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.5 p -85.81 172.65 10.62 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 121.593 0.711 . . . . 0.0 111.522 177.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.54 123.07 26.68 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.227 175.974 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' ASN . . . . . 0.533 ' HB2' ' CE2' ' A' ' 65' ' ' TRP . 74.5 m-20 -158.88 172.73 17.68 Favored 'General case' 0 CA--C 1.488 -1.439 0 C-N-CA 125.092 1.357 . . . . 0.0 107.421 172.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.69 ' HB3' ' O ' ' A' ' 21' ' ' SER . 2.2 mpt_? -100.96 -169.92 1.77 Allowed 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 178.631 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 16.0 p90 -154.41 160.99 41.95 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.663 1.574 . . . . 0.0 112.573 -177.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 75.3 mt -120.83 125.54 74.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.941 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 72.2 m -106.17 146.9 29.66 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.109 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -123.77 133.91 53.75 Favored 'General case' 0 N--CA 1.425 -1.718 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 173.453 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.7 tttm -109.81 109.21 19.8 Favored 'General case' 0 C--N 1.272 -2.763 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.35 124.23 28.68 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 121.353 0.597 . . . . 0.0 110.69 -172.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.636 HD21 ' SG ' ' A' ' 17' ' ' CYS . 2.9 mm? -75.82 -18.97 59.28 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.091 -178.271 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' TYR . . . . . 0.57 ' CD1' ' HB2' ' A' ' 15' ' ' ASP . 7.6 m-85 -94.87 22.99 5.86 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.045 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -61.96 -37.62 85.44 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 175.61 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -102.54 94.9 5.9 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 171.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 130' ' ' THR . . . . . 0.401 ' HB ' HD22 ' A' ' 131' ' ' LEU . 17.5 m -88.05 -30.94 19.55 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.401 HD22 ' HB ' ' A' ' 130' ' ' THR . 2.9 mm? -120.36 130.26 54.32 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 66.0 m -88.95 89.32 7.94 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 172.562 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -65.31 -58.22 6.46 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.971 -174.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 60.4 t80 66.96 -0.92 1.53 Allowed 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.708 178.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 31.9 t 67.91 17.94 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 CA-C-O 123.05 1.405 . . . . 0.0 108.121 -173.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -88.54 85.51 1.46 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 110.089 -1.204 . . . . 0.0 110.089 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -105.17 10.71 33.71 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 121.782 0.801 . . . . 0.0 109.141 -177.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 171.1 -49.25 0.19 Allowed Glycine 0 N--CA 1.428 -1.89 0 N-CA-C 109.262 -1.535 . . . . 0.0 109.262 -177.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 . . . . . 0 C--N 1.312 -1.029 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 176.412 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.1 m . . . . . 0 CA--C 1.544 0.736 0 CA-C-O 120.585 0.231 . . . . 0.0 111.544 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.87 133.67 36.05 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.667 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -62.94 163.56 9.5 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.068 0.461 . . . . 0.0 112.141 -178.565 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.667 ' O ' ' HG2' ' A' ' 3' ' ' LYS . 4.8 mp -91.78 -172.49 3.22 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 176.701 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -87.37 147.44 25.47 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -177.576 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.556 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 65.0 m -113.45 164.36 15.97 Favored Pre-proline 0 C--N 1.301 -1.508 0 CA-C-N 113.759 -1.564 . . . . 0.0 110.591 -177.1 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.29 164.06 18.59 Favored 'Trans proline' 0 C--N 1.367 1.501 0 C-N-CA 122.2 1.934 . . . . 0.0 112.377 175.469 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -53.98 -35.66 62.06 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -174.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.55 4.76 50.31 Favored 'General case' 0 C--N 1.317 -0.809 0 O-C-N 121.986 -0.446 . . . . 0.0 111.418 -175.049 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 24.9 m95 -112.89 145.93 39.85 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 120.821 0.343 . . . . 0.0 110.973 -174.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.1 mm? -100.62 178.83 4.6 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 105.271 -2.122 . . . . 0.0 105.271 173.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.556 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 56.1 p -155.89 148.81 24.25 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 119.525 1.057 . . . . 0.0 113.334 179.381 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 29.2 t-80 -154.37 135.96 14.32 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 67.83 -70.87 0.11 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.625 1.17 . . . . 0.0 113.828 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.454 ' C ' ' HD3' ' A' ' 16' ' ' LYS . 9.4 p-10 -167.31 24.69 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.839 -174.409 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.454 ' HD3' ' C ' ' A' ' 15' ' ' ASP . 3.9 mppt? -144.5 143.8 31.03 Favored 'General case' 0 CA--C 1.511 -0.547 0 C-N-CA 122.834 0.454 . . . . 0.0 110.358 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.563 ' O ' ' HA ' ' A' ' 123' ' ' GLN . 15.2 m -97.1 151.36 19.84 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 174.306 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -130.77 134.04 46.52 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 118.486 0.585 . . . . 0.0 110.046 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -119.76 108.94 15.02 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.6 t -83.87 93.79 3.29 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.778 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.5 m -77.67 110.8 12.81 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.243 -177.538 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 79.9 mm-40 -83.44 14.35 3.75 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.889 0.876 . . . . 0.0 112.962 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.59 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 6.7 m -107.14 153.55 8.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.7 m -108.83 143.96 37.32 Favored 'General case' 0 C--N 1.3 -1.543 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -173.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -154.3 172.98 16.8 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 126.476 1.91 . . . . 0.0 108.994 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.4 p -77.86 166.68 22.61 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 171.224 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 t90 -56.56 -50.96 70.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.337 0.589 . . . . 0.0 111.477 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.532 ' H ' ' CD ' ' A' ' 28' ' ' GLU . 0.1 OUTLIER -65.92 -35.95 82.04 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.993 -176.615 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -66.3 -45.06 81.69 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.832 -179.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.65 -32.24 82.76 Favored Glycine 0 N--CA 1.465 0.594 0 C-N-CA 121.39 -0.434 . . . . 0.0 112.388 176.415 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tt -61.28 -51.52 68.56 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 58.8 t -61.92 -32.08 53.1 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.331 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.547 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 0.9 OUTLIER -61.65 -45.3 94.64 Favored 'General case' 0 CA--C 1.501 -0.935 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.853 174.835 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 60.5 m -64.25 -41.92 96.74 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -56.69 -38.05 71.74 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 123.793 0.683 . . . . 0.0 109.637 176.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.26 -23.15 61.8 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 114.913 -1.039 . . . . 0.0 114.036 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.547 ' HD2' ' O ' ' A' ' 33' ' ' ASP . 2.1 mptp? -97.27 2.73 51.14 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 117.915 0.857 . . . . 0.0 110.711 177.284 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.93 50.01 25.68 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 108.499 -1.84 . . . . 0.0 108.499 -173.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.572 ' HB1' ' O ' ' A' ' 123' ' ' GLN . . . -147.82 176.77 9.87 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.402 ' HB ' HD11 ' A' ' 80' ' ' ILE . 1.6 p -116.14 164.86 13.86 Favored 'General case' 0 C--N 1.292 -1.917 0 C-N-CA 122.798 0.439 . . . . 0.0 110.684 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.0 tp -80.96 127.95 33.14 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 105.936 -1.876 . . . . 0.0 105.936 174.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.3 tpt -28.73 122.4 0.12 Allowed 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 -169.562 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -114.68 108.86 17.36 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.345 1.458 . . . . 0.0 107.387 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.499 HD13 HD11 ' A' ' 50' ' ' LEU . 52.9 mt -88.88 110.57 21.54 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.152 0.501 . . . . 0.0 111.512 -173.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -79.97 -32.32 39.85 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.794 -177.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -158.59 169.33 24.66 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -34.34 76.54 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 123.496 0.718 . . . . 0.0 109.62 178.507 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 12.0 pt-20 -58.38 -27.31 64.12 Favored 'General case' 0 C--O 1.243 0.723 0 C-N-CA 122.886 0.474 . . . . 0.0 111.363 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -66.92 -54.35 22.95 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 37.7 mt -66.65 -26.95 67.3 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.499 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 20.3 ptt180 -68.58 -32.02 71.64 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 119.331 -0.948 . . . . 0.0 109.363 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -74.26 -27.99 61.0 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.693 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -65.17 -48.15 74.48 Favored 'General case' 0 C--O 1.193 -1.906 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 46.3 mt -57.78 -33.43 68.52 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 123.412 0.445 . . . . 0.0 111.464 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.92 -41.76 97.57 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.551 175.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.3 p -88.27 -24.64 23.15 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -176.045 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.693 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.8 mm -56.33 -47.77 80.76 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 C-N-CA 123.603 0.761 . . . . 0.0 111.081 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 52.5 tptt 67.98 -69.65 0.14 Allowed 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.916 1.286 . . . . 0.0 113.696 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -65.55 -34.56 78.53 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.585 ' H ' HG22 ' A' ' 57' ' ' ILE . 49.4 mttp 72.98 -57.19 0.64 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.755 1.222 . . . . 0.0 112.354 177.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -68.74 6.55 0.83 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.168 1.387 . . . . 0.0 114.407 -170.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.593 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 51.2 m-80 -82.63 -168.49 2.04 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 173.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 8.3 m -140.22 114.51 9.19 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.134 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.593 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 4.9 m-85 -121.55 120.11 33.9 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.267 -177.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.42 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 55.0 m95 -62.81 137.59 58.31 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 123.067 0.547 . . . . 0.0 111.071 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.88 177.33 2.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 167.636 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.693 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.28 54.07 3.55 Favored Glycine 0 C--O 1.199 -2.07 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.382 -176.511 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 35.1 mt -126.52 118.28 24.58 Favored 'General case' 0 CA--C 1.489 -1.383 0 C-N-CA 123.55 0.74 . . . . 0.0 111.689 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -133.73 141.49 47.55 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 173.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.449 ' HE1' ' O ' ' A' ' 94' ' ' GLY . 59.1 t80 -86.14 112.59 21.45 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 104.26 -2.496 . . . . 0.0 104.26 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.48 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 1.2 p -85.68 119.75 26.37 Favored 'General case' 0 C--N 1.274 -2.681 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -173.574 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 70.4 mt -120.55 133.2 24.01 Favored Pre-proline 0 N--CA 1.432 -1.348 0 C-N-CA 120.409 -0.516 . . . . 0.0 110.869 174.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -85.73 135.97 20.18 Favored 'Cis proline' 0 CA--C 1.55 1.288 0 C-N-CA 122.791 -1.754 . . . . 0.0 111.287 -2.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.48 ' HB3' ' O ' ' A' ' 71' ' ' THR . 14.4 t70 173.37 -39.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 -175.441 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 2.1 mpt? 63.94 19.44 11.75 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.756 2.023 . . . . 0.0 115.381 174.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -120.56 162.31 19.84 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 122.145 -0.347 . . . . 0.0 110.112 176.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -95.27 111.46 23.31 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.313 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -114.38 147.65 38.86 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.102 -178.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.693 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 49.0 m95 -93.4 169.21 10.54 Favored 'General case' 0 N--CA 1.429 -1.522 0 CA-C-N 114.772 -1.103 . . . . 0.0 108.55 178.282 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.402 HD11 ' HB ' ' A' ' 40' ' ' THR . 40.8 pt -71.83 -13.9 17.11 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.909 -178.838 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.541 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 33.7 p-10 -89.84 -11.0 43.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.485 0.659 . . . . 0.0 109.402 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.12 1.05 44.84 Favored Glycine 0 CA--C 1.499 -0.918 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.155 174.123 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 57.2 m -80.04 165.77 22.21 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 122.834 0.454 . . . . 0.0 111.939 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.3 m -105.05 141.87 35.85 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.322 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.447 HD11 HD12 ' A' ' 92' ' ' ILE . 39.0 tp -56.91 140.21 49.21 Favored 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 124.98 1.312 . . . . 0.0 113.845 178.132 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -95.2 98.39 10.59 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 166.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.4 p -70.61 -8.68 53.48 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -175.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -78.44 -6.0 54.06 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 27.5 m -74.73 -48.22 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 C-N-CA 119.045 -1.062 . . . . 0.0 111.266 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.1 mt -153.78 177.56 10.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -177.717 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.89 109.51 2.11 Favored 'General case' 0 CA--C 1.499 -1.001 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.447 HD12 HD11 ' A' ' 85' ' ' LEU . 9.4 mt -146.66 106.3 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 171.072 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.7 m -63.97 122.26 16.07 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.449 ' O ' ' HE1' ' A' ' 70' ' ' TYR . . . -89.54 -19.53 48.43 Favored Glycine 0 N--CA 1.419 -2.445 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -174.442 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -122.3 104.84 9.7 Favored 'General case' 0 N--CA 1.422 -1.825 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 175.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.489 HG23 ' H ' ' A' ' 98' ' ' ASN . 12.3 t -141.36 -26.05 0.7 Allowed 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.4 -173.578 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 62.67 29.41 16.85 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.489 ' H ' HG23 ' A' ' 96' ' ' THR . 40.6 m-80 -122.53 143.84 49.47 Favored 'General case' 0 C--O 1.205 -1.282 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 175.683 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -82.55 27.32 0.52 Allowed 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 125.049 1.34 . . . . 0.0 110.622 -172.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 32.8 t -74.09 158.29 34.51 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 125.782 1.633 . . . . 0.0 112.276 -173.572 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 88.5 m -117.31 143.88 45.46 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -89.45 143.12 27.07 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-O 121.427 0.632 . . . . 0.0 112.154 -175.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -141.07 151.74 44.26 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.556 -178.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.439 HD11 HD22 ' A' ' 50' ' ' LEU . 13.9 mm -77.48 121.77 30.74 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 175.243 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 8.8 t -145.32 97.31 2.98 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.71 -119.83 6.66 Favored Glycine 0 C--N 1.283 -2.374 0 CA-C-N 114.317 -1.31 . . . . 0.0 110.186 179.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.506 ' OD2' ' HE2' ' A' ' 108' ' ' LYS . 6.5 p-10 -115.19 8.52 15.59 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 123.323 0.649 . . . . 0.0 109.249 177.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.506 ' HE2' ' OD2' ' A' ' 107' ' ' ASP . 74.4 mmtt -134.92 174.69 10.32 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.486 -176.266 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.3 t -101.39 130.65 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.031 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 175.83 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 59.1 p -131.6 141.83 49.75 Favored 'General case' 0 C--N 1.272 -2.788 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.437 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 6.8 p90 -99.79 133.1 44.64 Favored 'General case' 0 C--N 1.287 -2.115 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -177.78 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -121.1 165.75 14.89 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 114.427 -1.261 . . . . 0.0 107.622 -174.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 38.2 m -64.74 130.59 44.11 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 8.5 m -59.98 -19.64 53.35 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.417 0.627 . . . . 0.0 111.434 -175.471 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -93.38 4.39 54.04 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.255 1.022 . . . . 0.0 112.574 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.4 p -73.54 -7.95 53.96 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 13.8 t70 62.64 87.48 0.1 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.628 1.171 . . . . 0.0 110.392 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -127.81 175.07 8.61 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -177.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.778 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.2 mpt_? -83.43 -174.7 5.44 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 -177.739 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.447 ' CH2' HG23 ' A' ' 23' ' ' VAL . 26.9 p90 -156.58 172.72 18.08 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.659 1.118 . . . . 0.0 112.132 -177.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 85.5 mt -126.44 122.59 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-O 121.417 0.627 . . . . 0.0 110.128 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 74.3 m -100.12 143.72 29.99 Favored 'General case' 0 C--N 1.29 -2.022 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.572 ' O ' ' HB1' ' A' ' 39' ' ' ALA . 6.3 pt20 -121.54 154.06 37.18 Favored 'General case' 0 N--CA 1.417 -2.089 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 173.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.404 ' HB3' ' HB2' ' A' ' 17' ' ' CYS . 21.6 ttmm -132.33 110.47 10.6 Favored 'General case' 0 C--N 1.268 -2.95 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 176.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.454 ' HG3' ' ND1' ' A' ' 128' ' ' HIS . 0.8 OUTLIER -75.9 118.33 18.58 Favored 'General case' 0 C--N 1.282 -2.338 0 CA-C-O 121.648 0.737 . . . . 0.0 111.96 -177.304 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.65 ' HB3' HD13 ' A' ' 4' ' ' LEU . 2.6 mm? -69.12 -40.17 78.48 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.414 176.766 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -156.11 95.8 1.64 Allowed 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.703 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 128' ' ' HIS . . . . . 0.454 ' ND1' ' HG3' ' A' ' 125' ' ' GLU . 1.3 p-80 -79.28 151.81 30.9 Favored 'General case' 0 C--O 1.25 1.086 0 C-N-CA 118.973 -1.091 . . . . 0.0 108.809 173.087 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 71.65 -172.82 0.16 Allowed 'General case' 0 N--CA 1.469 0.49 0 O-C-N 124.3 1.0 . . . . 0.0 109.657 -175.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 59.5 m -140.0 129.52 24.22 Favored 'General case' 0 C--N 1.288 -2.099 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 176.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.407 ' H ' HD22 ' A' ' 131' ' ' LEU . 2.0 mm? -73.75 -42.75 60.68 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.478 -170.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 13.9 t -96.26 140.08 31.46 Favored 'General case' 0 N--CA 1.42 -1.933 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -115.28 -92.22 0.51 Allowed 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.879 -0.729 . . . . 0.0 111.89 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -147.99 132.38 17.58 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 -174.217 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.82 -8.44 9.53 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 175.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 97.22 -109.77 3.9 Favored Glycine 0 N--CA 1.43 -1.746 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -112.38 7.29 19.13 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 175.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 77.63 79.73 0.71 Allowed Glycine 0 N--CA 1.427 -1.951 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 -176.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 37.3 t60 . . . . . 0 C--N 1.304 -1.391 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -176.302 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . 0.494 ' H2 ' ' CG ' ' A' ' 15' ' ' ASP . 15.2 m . . . . . 0 N--CA 1.437 -1.123 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.401 ' O ' ' HB3' ' A' ' 3' ' ' LYS . . . -157.22 -38.71 0.07 Allowed 'General case' 0 CA--C 1.5 -0.966 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.165 -175.591 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.503 ' HB3' ' NZ ' ' A' ' 3' ' ' LYS . 3.5 ttpm? 71.06 113.69 0.05 Allowed 'General case' 0 N--CA 1.444 -0.745 0 O-C-N 124.327 1.017 . . . . 0.0 111.66 -174.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.434 HD13 ' HG ' ' A' ' 126' ' ' LEU . 2.2 mp -85.61 -163.09 0.8 Allowed 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 178.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -99.21 140.14 33.82 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.168 -1.013 . . . . 0.0 111.8 178.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 65.7 m -101.93 161.91 22.0 Favored Pre-proline 0 C--N 1.309 -1.179 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.665 -176.03 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.602 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 31.8 Cg_exo -61.81 156.37 48.93 Favored 'Trans proline' 0 CA--C 1.555 1.562 0 C-N-CA 121.612 1.541 . . . . 0.0 109.854 173.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -51.71 -33.66 35.34 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 116.528 2.048 . . . . 0.0 116.528 -169.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -97.71 5.77 48.83 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 121.714 -0.616 . . . . 0.0 111.887 -174.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.602 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 17.3 m95 -101.14 135.95 41.78 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 120.647 0.261 . . . . 0.0 111.302 -174.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.409 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.5 mm? -93.83 130.4 39.88 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.547 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 25.8 p -96.43 130.25 43.61 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -175.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -151.09 119.44 6.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.954 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.407 ' HD3' ' OE1' ' A' ' 48' ' ' GLU . 21.8 mtm180 54.68 46.36 24.85 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 125.849 1.659 . . . . 0.0 112.796 175.315 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.543 ' OD1' ' HE1' ' A' ' 127' ' ' TYR . 14.5 m-20 69.73 36.27 2.15 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.136 0.974 . . . . 0.0 111.026 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' A' ' 12' ' ' SER . 10.2 mptt -141.72 159.83 41.42 Favored 'General case' 0 CA--C 1.499 -1.001 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 174.236 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.709 ' SG ' HD13 ' A' ' 126' ' ' LEU . 4.6 m -129.44 132.26 46.93 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 177.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 19.3 m-85 -111.41 137.28 49.4 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 117.911 0.323 . . . . 0.0 110.832 -177.157 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.452 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 42.3 t-80 -121.11 108.33 13.67 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.7 t -88.22 93.59 4.31 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 176.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.73 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 4.1 m -77.76 113.56 15.75 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.053 -177.079 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.473 ' C ' ' HG2' ' A' ' 119' ' ' ARG . 84.8 mm-40 -85.0 14.36 5.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.803 0.841 . . . . 0.0 111.962 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 13.9 m -105.68 157.21 6.38 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 179.269 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 m -110.4 147.29 34.3 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -169.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.446 ' HB3' ' HB3' ' A' ' 29' ' ' GLU . 35.2 m-20 -159.73 -178.07 6.81 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 126.491 1.916 . . . . 0.0 108.7 -178.555 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 71.2 p -86.5 170.38 11.98 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 171.454 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 87.9 t90 -59.91 -51.58 69.09 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.016 0.436 . . . . 0.0 110.43 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.483 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 49.9 mt-10 -67.47 -31.23 71.24 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.726 -177.291 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLU . . . . . 0.446 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 7.8 tp10 -67.21 -49.55 64.13 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.88 -31.92 80.1 Favored Glycine 0 C--N 1.344 0.975 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.782 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.483 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 3.1 tm? -55.2 -51.29 67.03 Favored 'General case' 0 C--O 1.251 1.158 0 C-N-CA 124.17 0.988 . . . . 0.0 109.04 176.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 57.5 t -67.06 -35.09 73.64 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.468 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.43 -36.55 76.1 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 176.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 61.8 m -70.61 -41.86 71.72 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.417 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -61.74 -25.66 67.58 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.88 -37.16 93.89 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.761 -0.654 . . . . 0.0 113.199 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -86.46 2.73 46.77 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.858 -0.201 . . . . 0.0 110.779 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.52 41.38 30.02 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 108.665 -1.774 . . . . 0.0 108.665 -174.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -132.83 177.07 7.92 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.783 -0.708 . . . . 0.0 109.227 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.486 ' HB ' HD11 ' A' ' 80' ' ' ILE . 2.7 p -120.9 154.04 36.41 Favored 'General case' 0 C--N 1.279 -2.479 0 O-C-N 123.634 0.584 . . . . 0.0 109.498 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.6 tp -66.05 139.81 58.22 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 172.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.9 tpt -35.82 118.75 0.52 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 114.681 1.364 . . . . 0.0 114.681 -170.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.0 tp -120.51 106.35 11.72 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 -174.525 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.521 HD13 HD11 ' A' ' 50' ' ' LEU . 30.7 mt -98.05 112.96 31.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 CA-C-O 121.25 0.548 . . . . 0.0 111.949 -169.04 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -90.16 -31.22 17.16 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.67 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -143.65 161.54 38.27 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -173.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.9 tt0 -74.32 -25.36 59.51 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 122.536 0.334 . . . . 0.0 110.565 -178.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.657 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 7.7 pt-20 -69.08 -26.13 64.79 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.935 176.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -57.27 -54.1 50.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 173.164 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.521 HD11 HD13 ' A' ' 44' ' ' ILE . 62.4 mt -67.69 -26.8 66.36 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.657 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 4.1 ppt_? -66.45 -36.6 83.18 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -73.44 -25.74 60.64 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.674 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -63.53 -48.82 75.96 Favored 'General case' 0 CA--C 1.477 -1.848 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 172.941 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 37.7 mt -55.12 -38.8 68.65 Favored 'General case' 0 C--O 1.244 0.784 0 O-C-N 123.756 0.66 . . . . 0.0 110.717 177.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -59.16 -43.19 92.1 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.73 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.8 p -81.26 -27.01 35.34 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 53' ' ' LEU . 32.7 mm -67.1 -58.21 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.562 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -178.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? 67.36 -59.07 0.41 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.84 0.856 . . . . 0.0 112.921 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -61.04 -60.36 3.9 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 123.079 0.552 . . . . 0.0 112.418 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt 71.16 15.51 6.47 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.9 0.88 . . . . 0.0 113.044 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 67.0 m-85 -125.59 30.84 5.66 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.631 0.729 . . . . 0.0 111.62 -179.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 105' ' ' SER . 65.2 m-80 -127.11 -159.66 0.95 Allowed 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 175.136 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 54.7 m -151.97 126.68 9.54 Favored 'General case' 0 C--O 1.25 1.107 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 173.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.548 ' CE2' HD12 ' A' ' 57' ' ' ILE . 1.1 m-85 -128.83 118.78 23.32 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -176.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.408 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 70.3 m95 -59.38 140.14 56.39 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 123.804 0.842 . . . . 0.0 112.018 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -119.53 174.48 4.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 169.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.646 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.84 58.54 3.48 Favored Glycine 0 C--O 1.205 -1.703 0 CA-C-N 119.294 0.952 . . . . 0.0 113.76 -175.006 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.9 mt -127.44 113.86 16.74 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 123.743 0.817 . . . . 0.0 111.282 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -122.42 137.65 54.8 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.553 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -93.52 113.06 25.09 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.48 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 9.3 p -102.72 126.49 49.84 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.413 -174.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.52 HD11 ' HA ' ' A' ' 97' ' ' GLU . 57.7 mt -120.69 144.88 39.76 Favored Pre-proline 0 C--N 1.31 -1.125 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 174.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -83.27 128.15 13.36 Favored 'Cis proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.366 -1.514 . . . . 0.0 111.574 -1.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.48 ' HB3' ' O ' ' A' ' 71' ' ' THR . 27.7 t70 179.94 -46.45 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.502 0.721 . . . . 0.0 109.505 -177.008 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 86.2 mtp 70.54 17.58 6.72 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 175.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 90.5 m-20 -120.64 145.14 47.71 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 120.589 -0.445 . . . . 0.0 110.359 175.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -87.88 125.4 34.46 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 176.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -124.0 155.3 38.49 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 119.689 -0.804 . . . . 0.0 111.125 175.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.646 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 19.3 m95 -90.53 176.01 6.85 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 114.548 -1.205 . . . . 0.0 108.522 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.486 HD11 ' HB ' ' A' ' 40' ' ' THR . 49.8 pt -72.71 -15.48 17.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -177.639 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.454 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 30.5 p-10 -88.11 -7.97 56.14 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.73 8.08 62.44 Favored Glycine 0 N--CA 1.444 -0.816 0 CA-C-N 114.771 -1.104 . . . . 0.0 113.766 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.4 t -81.09 167.82 19.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.323 0.562 . . . . 0.0 109.613 -179.082 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.1 m -90.46 139.68 30.45 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.551 HD11 HD12 ' A' ' 92' ' ' ILE . 35.0 tp -55.18 138.99 43.48 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.015 173.402 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.481 ' OD1' HG13 ' A' ' 89' ' ' VAL . 26.4 t-20 -98.29 91.46 5.24 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 170.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 39.5 p -71.88 -4.92 30.89 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.3 0.572 . . . . 0.0 111.849 -177.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -75.43 -18.13 59.99 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.555 -178.098 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.481 HG13 ' OD1' ' A' ' 86' ' ' ASN . 33.6 m -75.41 -55.47 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.511 0 C-N-CA 119.111 -1.036 . . . . 0.0 112.494 -177.436 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.514 HD12 HD13 ' A' ' 50' ' ' LEU . 87.0 mt -145.51 -177.8 5.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.014 0.435 . . . . 0.0 111.344 -172.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.561 ' O ' ' HB ' ' A' ' 109' ' ' VAL . 10.7 tptm -57.72 98.69 0.03 OUTLIER 'General case' 0 C--O 1.208 -1.093 0 C-N-CA 125.866 1.666 . . . . 0.0 112.182 176.725 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.551 HD12 HD11 ' A' ' 85' ' ' LEU . 4.8 mt -150.69 111.02 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.911 0 N-CA-C 106.822 -1.548 . . . . 0.0 106.822 171.48 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.1 m -71.45 133.7 46.07 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 177.509 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.81 -53.99 3.2 Favored Glycine 0 CA--C 1.47 -2.753 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -173.584 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -96.87 132.02 43.03 Favored 'General case' 0 N--CA 1.421 -1.894 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.9 t -152.25 -19.92 0.17 Allowed 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.804 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.52 ' HA ' HD11 ' A' ' 72' ' ' LEU . 5.8 mm-40 60.88 36.14 19.04 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 123.964 0.906 . . . . 0.0 113.377 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -117.47 171.73 7.8 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.693 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -93.85 28.32 2.43 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 125.762 1.625 . . . . 0.0 108.021 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.401 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 66.8 m -84.11 155.73 22.49 Favored 'General case' 0 N--CA 1.422 -1.854 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -169.358 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 84.0 m -131.63 149.33 52.53 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 105.858 -1.904 . . . . 0.0 105.858 171.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -91.09 146.45 23.83 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -173.166 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.48 144.84 32.16 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.588 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' A' ' 63' ' ' SER . 7.7 mm -77.33 124.74 36.29 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 177.033 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.479 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 23.3 t -94.07 -43.21 8.61 Favored 'General case' 0 N--CA 1.414 -2.233 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 173.73 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.52 -109.36 0.22 Allowed Glycine 0 N--CA 1.418 -2.563 0 N-CA-C 109.12 -1.592 . . . . 0.0 109.12 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -75.81 -19.16 59.16 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -110.89 154.47 24.0 Favored 'General case' 0 C--O 1.259 1.589 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.201 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.561 ' HB ' ' O ' ' A' ' 91' ' ' LYS . 23.6 t -106.0 130.03 58.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 175.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.0 p -130.94 151.65 51.13 Favored 'General case' 0 C--N 1.27 -2.887 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -174.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.401 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 19.7 p90 -126.83 133.11 50.83 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 -173.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -129.46 174.51 9.57 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 19.7 m -53.94 129.96 35.84 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.76 0.662 . . . . 0.0 109.224 174.355 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.2 m -58.87 -20.55 52.18 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.864 0.866 . . . . 0.0 112.33 -174.478 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.7 p-10 -80.6 -9.08 59.8 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.291 -179.677 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 51.0 p -68.02 144.8 54.98 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 120.346 -0.541 . . . . 0.0 110.753 -177.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -80.84 89.32 5.83 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.504 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' ASN . . . . . 0.549 ' OD1' ' HB2' ' A' ' 63' ' ' SER . 35.1 m-80 -125.92 170.48 11.63 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.449 -178.123 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.73 ' HB3' ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -89.82 179.6 5.95 Favored 'General case' 0 C--N 1.287 -2.117 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 -178.304 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.411 ' CZ3' HG23 ' A' ' 23' ' ' VAL . 17.9 p90 -153.24 165.01 37.06 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.757 1.162 . . . . 0.0 112.201 -175.236 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.433 HD13 HD12 ' A' ' 53' ' ' LEU . 80.8 mt -120.18 127.31 75.89 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.973 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 70.9 m -106.89 142.58 36.29 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.418 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 2.1 pt20 -124.18 135.93 53.82 Favored 'General case' 0 N--CA 1.417 -2.093 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 171.816 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -108.94 109.25 20.28 Favored 'General case' 0 C--N 1.254 -3.554 0 N-CA-C 105.411 -2.07 . . . . 0.0 105.411 174.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.487 ' O ' ' HB2' ' A' ' 128' ' ' HIS . 36.9 tt0 -68.62 124.4 23.5 Favored 'General case' 0 N--CA 1.414 -2.241 0 N-CA-C 104.499 -2.408 . . . . 0.0 104.499 174.082 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.709 HD13 ' SG ' ' A' ' 17' ' ' CYS . 6.8 tp -66.44 -22.39 66.22 Favored 'General case' 0 C--N 1.284 -2.261 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.598 -166.428 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' TYR . . . . . 0.543 ' HE1' ' OD1' ' A' ' 15' ' ' ASP . 50.9 m-85 -101.27 92.2 4.85 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 168.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 128' ' ' HIS . . . . . 0.487 ' HB2' ' O ' ' A' ' 125' ' ' GLU . 26.2 t-80 -128.53 19.15 6.27 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 122.383 1.087 . . . . 0.0 108.837 -175.076 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -77.78 76.77 4.3 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.119 -176.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 8.1 m -88.84 -14.25 37.38 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 172.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 85.1 mt -133.36 141.1 47.75 Favored 'General case' 0 N--CA 1.427 -1.601 0 N-CA-C 105.069 -2.197 . . . . 0.0 105.069 176.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 32.0 t -84.35 -73.37 0.43 Allowed 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 177.428 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -123.63 -52.68 1.8 Allowed 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -149.88 160.76 43.32 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.347 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 74.6 t -83.12 -38.56 14.67 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-O 121.401 0.619 . . . . 0.0 110.978 178.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 91.2 -62.97 2.8 Favored Glycine 0 C--O 1.22 -0.724 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -176.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -84.2 15.36 3.57 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 122.141 0.972 . . . . 0.0 110.638 175.186 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -129.29 11.0 6.14 Favored Glycine 0 N--CA 1.428 -1.852 0 N-CA-C 108.391 -1.884 . . . . 0.0 108.391 173.582 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 83.1 t60 . . . . . 0 C--O 1.244 0.8 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 -178.347 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.7 m . . . . . 0 N--CA 1.446 -0.661 0 CA-C-O 120.683 0.278 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.71 -179.83 3.98 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 175.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.533 ' HB2' ' O ' ' A' ' 14' ' ' ARG . 13.5 tppt? -123.57 -59.67 1.52 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 122.011 0.91 . . . . 0.0 109.159 -177.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.581 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 5.0 mp -121.62 -176.86 3.41 Favored 'General case' 0 C--N 1.261 -3.239 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 171.531 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -95.34 141.17 29.22 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.583 0.706 . . . . 0.0 111.343 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' CYS . . . . . 0.485 ' HB3' HD11 ' A' ' 126' ' ' LEU . 14.6 p -125.95 170.76 8.9 Favored Pre-proline 0 C--N 1.29 -2.006 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.026 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.647 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 52.3 Cg_exo -58.42 152.77 51.99 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 122.855 2.37 . . . . 0.0 112.487 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -58.55 -31.63 68.14 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 -171.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -89.92 8.68 31.03 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.405 0.622 . . . . 0.0 110.641 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.647 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 31.8 m95 -111.4 131.23 55.35 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.913 -176.51 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.7 mm? -85.2 117.71 24.31 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.595 ' HA ' ' SG ' ' A' ' 17' ' ' CYS . 1.8 m -78.95 123.59 27.42 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.96 -175.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 27.7 t-80 -145.29 114.11 6.86 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 122.019 -0.425 . . . . 0.0 110.044 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.533 ' O ' ' HB2' ' A' ' 3' ' ' LYS . 56.6 mtp180 71.02 -85.17 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.31 1.044 . . . . 0.0 111.88 176.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -146.42 19.2 1.36 Allowed 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 123.816 0.847 . . . . 0.0 109.98 -176.384 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.51 ' HG2' ' NE2' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -143.56 160.33 40.82 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 175.961 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.595 ' SG ' ' HA ' ' A' ' 12' ' ' SER . 79.3 m -125.99 142.3 51.58 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 173.543 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -110.8 144.04 40.41 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.738 0.304 . . . . 0.0 111.684 -171.358 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -123.25 109.07 13.5 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 176.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.7 t -83.92 91.94 2.86 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.179 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.731 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 6.5 m -78.33 105.84 9.85 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -77.49 14.43 1.0 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.47 1.108 . . . . 0.0 112.65 -179.367 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.536 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.0 m -108.62 157.92 8.66 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.932 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.4 m -106.84 156.77 18.33 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -171.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 33.4 m-20 -167.81 175.29 6.96 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 128.024 2.53 . . . . 0.0 107.948 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.1 p -82.01 176.61 9.4 Favored 'General case' 0 C--O 1.257 1.471 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 171.348 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -61.81 -50.86 70.62 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.276 49.1 mt-10 -67.68 -30.62 70.19 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.81 -49.26 68.89 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.818 -0.753 . . . . 0.0 110.965 172.756 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.85 -33.9 86.93 Favored Glycine 0 C--N 1.339 0.741 0 N-CA-C 111.522 -0.631 . . . . 0.0 111.522 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.33 -52.87 62.07 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.848 0.859 . . . . 0.0 108.992 176.173 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.48 -31.8 52.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.198 0.523 . . . . 0.0 111.019 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.441 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 1.0 OUTLIER -62.46 -36.38 82.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.487 176.625 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.3 m -68.1 -41.09 82.32 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 175.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -57.36 -35.92 70.56 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.413 0.625 . . . . 0.0 109.622 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -63.08 -14.54 53.63 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 115.013 -0.994 . . . . 0.0 114.061 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LYS . . . . . 0.441 ' HD2' ' O ' ' A' ' 33' ' ' ASP . 3.3 mptp? -108.36 3.54 23.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 117.622 0.711 . . . . 0.0 110.644 176.279 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.87 28.79 66.2 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -174.63 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -118.51 176.84 5.06 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 124.261 1.024 . . . . 0.0 108.705 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -123.52 149.69 44.9 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.56 125.57 25.61 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 177.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.4 tpt -26.62 121.98 0.08 Allowed 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 116.732 2.123 . . . . 0.0 116.732 -169.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.441 HD12 ' HB3' ' A' ' 79' ' ' TRP . 2.8 mm? -112.16 105.27 13.57 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.927 1.291 . . . . 0.0 107.599 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.481 HD13 HD11 ' A' ' 50' ' ' LEU . 56.5 mt -85.3 117.94 31.29 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.134 -175.677 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -82.5 -54.49 5.15 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.265 0.555 . . . . 0.0 111.404 179.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.583 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 17.1 m-20 -137.04 -179.02 5.46 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 122.119 -0.363 . . . . 0.0 111.072 -171.086 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -39.63 80.72 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 -178.365 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -58.71 -28.26 65.65 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.792 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.583 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 6.5 mm-40 -60.21 -55.18 36.9 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 175.479 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.638 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 46.3 mt -68.85 -26.09 64.97 Favored 'General case' 0 C--O 1.202 -1.424 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -177.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -64.25 -38.32 90.63 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.308 -0.557 . . . . 0.0 109.694 174.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -73.1 -28.5 62.32 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.63 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -66.22 -51.89 53.2 Favored 'General case' 0 C--O 1.183 -2.425 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 174.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 50.9 mt -54.8 -33.36 61.39 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -72.89 -46.21 53.98 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.543 174.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.3 p -75.53 -27.04 58.54 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.127 0.489 . . . . 0.0 111.831 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.63 HG12 ' O ' ' A' ' 53' ' ' LEU . 34.2 mm -58.7 -48.92 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.243 174.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? 67.99 -66.41 0.22 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.037 0.935 . . . . 0.0 112.667 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -62.01 -51.28 68.67 Favored 'General case' 0 C--O 1.207 -1.142 0 C-N-CA 123.842 0.857 . . . . 0.0 111.131 -176.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.51 ' H ' HG22 ' A' ' 57' ' ' ILE . 3.8 ttmp? 71.31 -40.85 0.49 Allowed 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -80.81 37.68 0.43 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.787 0.803 . . . . 0.0 112.911 -174.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.607 ' O ' ' HA ' ' A' ' 105' ' ' SER . 54.2 m-80 -124.97 -158.88 0.85 Allowed 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 176.263 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.46 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 15.3 m -143.28 117.82 9.75 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.521 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 2.2 m-85 -122.56 117.5 26.03 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -63.15 139.77 58.81 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 123.063 0.545 . . . . 0.0 111.428 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -117.76 172.76 5.09 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 168.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.59 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -74.92 44.09 1.5 Allowed Glycine 0 C--O 1.216 -1.01 0 CA-C-N 119.132 0.878 . . . . 0.0 114.544 -174.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.509 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 28.8 mt -114.37 123.68 50.07 Favored 'General case' 0 CA--C 1.483 -1.614 0 C-N-CA 123.793 0.837 . . . . 0.0 111.898 -178.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -142.52 140.69 31.91 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 120.086 -0.645 . . . . 0.0 110.076 171.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.558 ' HD2' ' O ' ' A' ' 98' ' ' ASN . 82.9 t80 -83.02 113.21 20.43 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.447 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 32.5 p -102.38 132.93 48.06 Favored 'General case' 0 C--N 1.283 -2.284 0 C-N-CA 119.856 -0.738 . . . . 0.0 112.325 -173.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.6 mt -120.58 140.17 30.01 Favored Pre-proline 0 N--CA 1.428 -1.526 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.899 174.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -86.81 132.76 14.06 Favored 'Cis proline' 0 N--CA 1.452 -0.932 0 C-N-CA 123.298 -1.542 . . . . 0.0 110.757 -3.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.447 ' HB3' ' O ' ' A' ' 71' ' ' THR . 11.6 t70 178.46 -42.8 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 -174.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 4.4 mpp? 65.27 17.28 10.94 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 113.619 -1.628 . . . . 0.0 114.258 176.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -122.47 158.22 30.26 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.26 0.552 . . . . 0.0 110.789 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.507 ' HE1' ' HA2' ' A' ' 94' ' ' GLY . 83.0 m95 -88.92 112.71 23.63 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 173.513 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -116.86 154.64 30.41 Favored 'General case' 0 C--N 1.278 -2.504 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.922 -176.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.59 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 47.2 m95 -98.55 165.5 11.79 Favored 'General case' 0 N--CA 1.425 -1.722 0 CA-C-N 114.504 -1.225 . . . . 0.0 109.353 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.1 pt -73.28 -13.76 16.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.063 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -92.61 -0.66 57.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.396 0.617 . . . . 0.0 109.844 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.46 -2.72 57.59 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.016 -0.993 . . . . 0.0 114.256 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.1 t -84.82 170.6 13.01 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 117.609 0.705 . . . . 0.0 109.852 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.3 m -112.15 145.49 39.72 Favored 'General case' 0 N--CA 1.419 -2.004 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 43.0 tp -53.86 131.98 40.87 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -178.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -86.51 87.85 7.52 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 168.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.2 m -64.18 -10.88 25.82 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.923 -177.117 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -77.72 -6.56 54.41 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 22.6 m -74.32 -48.96 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 118.764 -1.174 . . . . 0.0 111.924 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.2 mt -156.72 -178.09 7.09 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 -175.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -73.49 123.31 23.67 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.0 mt -142.59 132.33 22.6 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 N-CA-C 105.721 -1.955 . . . . 0.0 105.721 171.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.2 m -112.71 131.94 55.43 Favored 'General case' 0 C--N 1.288 -2.083 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.192 -173.633 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.507 ' HA2' ' HE1' ' A' ' 77' ' ' TRP . . . -91.87 -14.46 56.44 Favored Glycine 0 N--CA 1.426 -2.028 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -77.25 111.16 12.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 174.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 98' ' ' ASN . 5.5 t -171.32 -42.86 0.02 OUTLIER 'General case' 0 C--N 1.274 -2.674 0 CA-C-N 114.473 -1.239 . . . . 0.0 108.43 -175.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 68.09 19.06 9.34 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.145 1.378 . . . . 0.0 111.373 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.558 ' O ' ' HD2' ' A' ' 70' ' ' TYR . 26.3 m-80 -121.71 152.9 38.9 Favored 'General case' 0 CA--C 1.498 -1.048 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -72.16 30.46 0.05 Allowed 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 126.346 1.858 . . . . 0.0 110.527 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.452 ' H ' ' C ' ' A' ' 98' ' ' ASN . 41.0 t -62.36 149.07 43.35 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 126.14 1.776 . . . . 0.0 112.802 -172.186 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 90.1 m -112.92 145.31 40.97 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.067 -0.969 . . . . 0.0 108.794 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.481 ' HB1' HG12 ' A' ' 109' ' ' VAL . . . -98.0 147.2 24.74 Favored 'General case' 0 C--O 1.255 1.364 0 CA-C-O 121.3 0.571 . . . . 0.0 111.898 -176.396 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -139.53 152.21 46.74 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.486 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.46 ' O ' ' HA ' ' A' ' 63' ' ' SER . 17.3 mm -77.85 112.53 15.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 N-CA-C 105.388 -2.079 . . . . 0.0 105.388 172.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.607 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 8.5 t -131.82 33.53 3.96 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-O 122.376 1.084 . . . . 0.0 108.511 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.66 -139.82 6.65 Favored Glycine 0 N--CA 1.412 -2.913 0 N-CA-C 108.277 -1.929 . . . . 0.0 108.277 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.433 ' OD2' ' HE3' ' A' ' 108' ' ' LYS . 14.2 p-10 -98.99 8.82 44.64 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.363 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.433 ' HE3' ' OD2' ' A' ' 107' ' ' ASP . 32.4 mmtp -130.43 163.65 26.46 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.102 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.481 HG12 ' HB1' ' A' ' 102' ' ' ALA . 2.8 t -99.11 119.83 47.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.1 p -122.04 143.78 49.3 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.41 ' HA ' ' HA ' ' A' ' 102' ' ' ALA . 23.6 p90 -109.67 145.86 35.8 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -135.76 175.43 9.6 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.79 -1.096 . . . . 0.0 109.942 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.3 m -67.57 127.06 31.33 Favored 'General case' 0 N--CA 1.413 -2.305 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 171.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 20.5 m -56.33 -21.79 26.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.465 0.706 . . . . 0.0 112.585 -173.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.0 p-10 -77.15 -3.46 39.59 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 30.6 p -75.97 140.39 42.02 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 119.316 0.962 . . . . 0.0 111.389 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.58 89.1 7.05 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.546 0.689 . . . . 0.0 109.444 -177.011 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -120.78 174.38 6.63 Favored 'General case' 0 C--O 1.196 -1.759 0 C-N-CA 124.563 1.145 . . . . 0.0 109.832 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.731 ' HB3' ' O ' ' A' ' 21' ' ' SER . 3.4 mpt_? -85.87 -178.77 6.67 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -176.163 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 24.8 p90 -153.18 162.77 40.93 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 118.688 -1.205 . . . . 0.0 111.999 -176.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 75.6 mt -120.13 125.57 74.37 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-O 121.237 0.542 . . . . 0.0 109.856 178.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 71.7 m -105.24 145.25 30.9 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 176.538 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.51 ' NE2' ' HG2' ' A' ' 16' ' ' LYS . 8.7 pt20 -122.61 133.5 54.54 Favored 'General case' 0 N--CA 1.412 -2.326 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 171.258 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -110.66 108.0 17.76 Favored 'General case' 0 N--CA 1.397 -3.124 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 173.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.462 ' HA ' ' HA ' ' A' ' 16' ' ' LYS . 42.3 tt0 -68.74 134.43 49.77 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-N 113.989 -1.459 . . . . 0.0 108.365 -177.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.581 ' HG ' ' H ' ' A' ' 4' ' ' LEU . 1.7 mm? -67.37 -27.38 67.06 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.782 0.801 . . . . 0.0 109.404 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' TYR . . . . . 0.439 ' H ' ' HG2' ' A' ' 125' ' ' GLU . 10.7 m-85 -89.1 21.9 3.0 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.853 177.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.67 -6.66 38.71 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -54.65 108.9 0.43 Allowed 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.577 -1.192 . . . . 0.0 107.988 175.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 6.7 m -89.18 154.87 19.8 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 -178.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.88 -35.25 80.02 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 18.0 m -124.14 96.35 4.89 Favored 'General case' 0 N--CA 1.422 -1.849 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 173.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -86.49 70.36 10.45 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -174.86 161.82 3.1 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 105.271 -2.122 . . . . 0.0 105.271 -174.438 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 57.6 t -71.59 -39.3 69.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 177.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 95.41 -11.12 69.05 Favored Glycine 0 CA--C 1.504 -0.651 0 N-CA-C 115.122 0.809 . . . . 0.0 115.122 168.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 60.42 17.55 7.32 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.702 0.801 . . . . 0.0 110.507 -178.241 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 137.38 -30.33 2.62 Favored Glycine 0 N--CA 1.43 -1.763 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.909 -176.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 . . . . . 0 C--N 1.308 -1.238 0 O-C-N 122.353 -0.498 . . . . 0.0 110.025 -179.719 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.7 m . . . . . 0 C--O 1.236 0.344 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 66.63 110.81 0.04 OUTLIER 'General case' 0 C--N 1.349 0.583 0 C-N-CA 124.091 0.957 . . . . 0.0 109.631 -175.155 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 2.2 tmpt? 71.62 131.45 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 122.417 1.103 . . . . 0.0 112.487 -173.16 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.584 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 5.0 mp -100.04 179.38 4.51 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 175.648 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -80.67 140.52 35.6 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.766 0.793 . . . . 0.0 112.583 -176.443 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.8 p -128.18 165.92 27.52 Favored Pre-proline 0 C--N 1.296 -1.759 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.517 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.695 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 52.4 Cg_exo -54.08 162.16 4.34 Favored 'Trans proline' 0 C--N 1.373 1.826 0 C-N-CA 123.222 2.615 . . . . 0.0 115.084 -178.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 24.9 pt20 -59.78 -35.49 74.75 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 115.212 1.56 . . . . 0.0 115.212 -173.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -89.7 3.08 53.85 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -175.215 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.695 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 16.9 m95 -101.11 153.11 19.86 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.628 -171.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -108.38 124.4 50.31 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.8 p -90.82 126.61 36.08 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -176.098 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.463 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 54.1 t-80 -146.21 115.13 6.93 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 123.002 0.521 . . . . 0.0 110.086 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.25 3.9 mpt_? 53.58 59.14 4.53 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 174.628 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . 0.523 ' HB3' ' CD1' ' A' ' 127' ' ' TYR . 10.5 m-20 62.65 24.83 14.78 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.446 174.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -145.67 148.01 32.6 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.407 ' SG ' ' HB3' ' A' ' 10' ' ' TRP . 7.3 t -130.78 134.48 46.9 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -176.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.463 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 11.8 m-85 -111.77 149.87 31.09 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -170.765 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.512 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 45.3 t-80 -129.52 116.94 19.68 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 172.619 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.01 93.57 3.87 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 174.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.726 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 13.3 m -77.8 107.76 10.54 Favored 'General case' 0 N--CA 1.416 -2.159 0 CA-C-N 115.306 -0.861 . . . . 0.0 108.696 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 77.7 mm-40 -83.55 13.92 4.17 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.603 0.716 . . . . 0.0 111.15 -179.714 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.478 HG23 ' CH2' ' A' ' 120' ' ' TRP . 5.7 m -100.62 158.32 3.99 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.149 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 118' ' ' ASN . 13.2 m -109.97 151.59 26.93 Favored 'General case' 0 C--N 1.294 -1.81 0 C-N-CA 118.776 -1.17 . . . . 0.0 114.091 -171.034 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -167.09 174.66 8.11 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 127.39 2.276 . . . . 0.0 108.426 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.5 p -86.37 171.89 10.83 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 107.443 -1.318 . . . . 0.0 107.443 170.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -56.54 -52.99 62.68 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -174.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -31.26 70.38 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.956 0.408 . . . . 0.0 111.779 -175.609 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -70.23 -45.25 66.89 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.888 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.88 -32.04 82.83 Favored Glycine 0 C--N 1.341 0.824 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.403 ' HA ' ' HB2' ' A' ' 41' ' ' LEU . 5.0 tt -56.42 -51.21 69.24 Favored 'General case' 0 C--O 1.242 0.682 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 176.234 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.1 t -67.8 -33.24 60.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.839 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -60.11 -37.06 78.87 Favored 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 82.9 m -65.32 -42.35 93.07 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -61.16 -27.73 68.61 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.194 177.122 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -58.64 -34.98 78.89 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.576 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -95.73 8.93 42.09 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 122.26 -0.553 . . . . 0.0 109.704 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.8 43.67 93.58 Favored Glycine 0 CA--C 1.503 -0.68 0 N-CA-C 109.695 -1.362 . . . . 0.0 109.695 -175.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -130.05 174.91 9.33 Favored 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 -177.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -119.29 150.83 39.47 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 118.454 0.57 . . . . 0.0 110.972 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 25.9 tp -65.6 124.74 23.17 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 175.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.1 tpt -29.98 120.01 0.17 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 -169.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.404 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 2.9 mm? -109.3 110.6 21.82 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 114.191 -1.368 . . . . 0.0 107.505 176.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.9 mt -96.96 117.66 41.93 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -175.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.401 HE22 ' HB3' ' A' ' 43' ' ' LEU . 2.1 mp0 -100.2 -25.1 14.38 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -137.05 160.42 39.01 Favored 'General case' 0 CA--C 1.5 -0.973 0 CA-C-O 120.669 0.271 . . . . 0.0 110.77 -175.085 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -33.97 74.93 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.282 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.3 mp0 -58.6 -29.39 66.42 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.04 178.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -62.17 -54.45 40.86 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.647 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 58.1 mt -65.28 -26.01 67.9 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.355 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -62.9 -41.6 99.49 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -72.45 -28.06 62.7 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.611 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -64.11 -50.75 67.03 Favored 'General case' 0 C--O 1.18 -2.603 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 175.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 51.1 mt -54.86 -35.18 63.74 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 122.878 0.471 . . . . 0.0 111.974 -178.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.04 -42.34 73.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.296 -0.411 . . . . 0.0 112.102 175.18 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.6 p -81.63 -26.43 34.82 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.204 0.526 . . . . 0.0 112.283 -176.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.611 HG12 ' O ' ' A' ' 53' ' ' LEU . 35.4 mm -64.08 -47.36 90.56 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.261 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 tptt 67.1 -68.98 0.14 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.689 1.196 . . . . 0.0 112.62 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -65.48 -47.59 75.55 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -175.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.475 ' H ' HG22 ' A' ' 57' ' ' ILE . 96.0 mttt 75.17 -39.28 0.4 Allowed 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.639 1.176 . . . . 0.0 113.923 177.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -73.29 37.84 0.09 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -173.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.575 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 60.9 m-80 -128.0 -163.1 1.23 Allowed 'General case' 0 C--N 1.277 -2.578 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 174.156 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.618 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 50.3 m -139.16 119.54 13.81 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 176.302 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.575 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 6.2 m-85 -120.91 116.17 24.62 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -177.01 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.425 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 71.5 m95 -61.81 138.85 58.37 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 123.596 0.758 . . . . 0.0 111.492 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.14 175.63 4.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.149 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 168.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.645 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.04 47.96 2.33 Favored Glycine 0 C--O 1.209 -1.438 0 C-N-CA 120.784 -0.722 . . . . 0.0 114.375 -174.994 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.7 mt -114.25 121.72 44.57 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 123.283 0.633 . . . . 0.0 111.843 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -129.4 134.29 47.79 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.226 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -87.39 112.82 22.52 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 179.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.516 ' OG1' ' HE2' ' A' ' 78' ' ' LYS . 46.6 p -99.44 121.11 40.67 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.128 -172.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.408 HD11 ' HA ' ' A' ' 97' ' ' GLU . 63.4 mt -120.75 146.26 43.13 Favored Pre-proline 0 C--N 1.303 -1.417 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.731 176.725 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -85.25 126.16 9.74 Favored 'Cis proline' 0 C--O 1.242 0.701 0 C-N-CA 123.582 -1.424 . . . . 0.0 110.976 -3.554 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.9 t70 179.03 -46.38 0.01 OUTLIER 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -177.381 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 46.5 mtm 71.73 8.25 6.08 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.347 1.459 . . . . 0.0 113.755 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -95.93 146.67 24.41 Favored 'General case' 0 C--N 1.295 -1.782 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.173 173.639 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.405 ' HE1' ' HA2' ' A' ' 94' ' ' GLY . 77.5 m95 -86.93 119.93 27.67 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 175.305 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.516 ' HE2' ' OG1' ' A' ' 71' ' ' THR . 55.9 mttm -113.22 152.29 29.94 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -177.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.645 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 42.5 m95 -98.03 175.91 5.95 Favored 'General case' 0 C--N 1.288 -2.094 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 46.0 pt -71.93 -23.2 21.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 120.95 0.405 . . . . 0.0 111.334 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.3 p-10 -85.69 -9.68 56.83 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.628 0.728 . . . . 0.0 109.69 179.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.21 -0.08 44.11 Favored Glycine 0 CA--C 1.495 -1.18 0 CA-C-N 115.39 -0.823 . . . . 0.0 112.382 172.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.1 m -69.8 168.22 15.56 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 28.8 m -108.94 134.43 51.61 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.622 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.496 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 44.3 tp -54.45 142.27 27.85 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 124.84 1.256 . . . . 0.0 114.047 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -96.12 97.1 9.3 Favored 'General case' 0 N--CA 1.432 -1.335 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 169.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.1 m -70.65 -6.11 34.53 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.222 0.534 . . . . 0.0 111.328 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -78.3 -6.21 54.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.079 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.3 m -78.74 -54.47 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.31 0 C-N-CA 119.364 -0.934 . . . . 0.0 112.195 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 91.5 mt -157.37 -178.16 7.14 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.577 0.751 . . . . 0.0 109.188 -174.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.6 98.47 0.37 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -177.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.406 HD12 HD11 ' A' ' 85' ' ' LEU . 8.8 mt -139.23 103.54 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 173.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.491 HG22 ' H ' ' A' ' 95' ' ' ASP . 9.7 m -76.05 132.31 40.03 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.086 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLY . . . . . 0.405 ' HA2' ' HE1' ' A' ' 77' ' ' TRP . . . -106.26 12.61 44.14 Favored Glycine 0 CA--C 1.489 -1.559 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -177.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.491 ' H ' HG22 ' A' ' 93' ' ' THR . 7.2 p-10 -140.97 96.73 3.05 Favored 'General case' 0 C--N 1.285 -2.219 0 CA-C-O 121.557 0.694 . . . . 0.0 109.64 176.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.1 t -148.43 -20.48 0.33 Allowed 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.396 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.408 ' HA ' HD11 ' A' ' 72' ' ' LEU . 6.3 mm-40 56.81 82.08 0.12 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.983 0.913 . . . . 0.0 112.888 -177.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 16.2 m120 -157.0 178.06 10.8 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -108.83 26.17 10.89 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 123.137 1.446 . . . . 0.0 107.475 179.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.451 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 19.1 m -66.75 153.42 43.33 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -173.876 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -132.88 145.71 51.17 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 113.606 -1.634 . . . . 0.0 107.0 173.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -92.16 148.24 22.31 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -171.059 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.49 153.32 42.5 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.48 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 63' ' ' SER . 14.2 mm -77.7 120.14 27.75 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 174.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 34.1 t -134.97 94.21 3.12 Favored 'General case' 0 N--CA 1.421 -1.881 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.24 -126.41 8.09 Favored Glycine 0 N--CA 1.429 -1.825 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -102.3 8.39 40.38 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -126.74 166.83 16.66 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.263 -173.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 t -104.85 133.51 48.82 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.753 0 N-CA-C 104.766 -2.309 . . . . 0.0 104.766 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 43.2 p -127.98 170.47 12.83 Favored 'General case' 0 C--N 1.278 -2.501 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.451 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 11.3 p90 -130.35 125.28 34.23 Favored 'General case' 0 C--N 1.296 -1.758 0 C-N-CA 119.619 -0.832 . . . . 0.0 112.598 178.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -118.06 170.82 8.54 Favored 'General case' 0 C--N 1.294 -1.824 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.712 -172.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 19.1 m -72.0 127.84 33.82 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 170.202 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.6 m -50.71 -22.14 1.95 Allowed 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 125.495 1.518 . . . . 0.0 113.553 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -80.51 7.43 9.93 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 124.387 1.075 . . . . 0.0 111.561 -175.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 18.5 p -92.13 140.38 29.69 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.582 -0.699 . . . . 0.0 111.777 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -78.65 90.42 4.58 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.8 0.81 . . . . 0.0 109.294 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' ASN . . . . . 0.406 ' O ' ' HA ' ' A' ' 24' ' ' SER . 82.8 m-20 -126.61 -178.58 4.42 Favored 'General case' 0 C--O 1.196 -1.746 0 CA-C-N 114.94 -1.027 . . . . 0.0 108.991 -178.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.726 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.7 mpt_? -100.85 -175.44 2.89 Favored 'General case' 0 C--N 1.283 -2.293 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 -175.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.478 ' CH2' HG23 ' A' ' 23' ' ' VAL . 26.9 p90 -154.27 169.69 23.05 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 119.492 1.042 . . . . 0.0 112.199 -176.909 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.403 HG13 ' HB3' ' A' ' 64' ' ' PHE . 74.2 mt -122.22 125.74 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 CA-C-O 121.4 0.619 . . . . 0.0 109.855 178.142 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 87.0 m -104.1 142.82 33.8 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.448 -0.796 . . . . 0.0 108.929 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -117.93 132.76 56.37 Favored 'General case' 0 N--CA 1.413 -2.305 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 172.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.541 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 42.9 tttp -109.98 106.49 16.03 Favored 'General case' 0 C--N 1.251 -3.7 0 N-CA-C 104.048 -2.575 . . . . 0.0 104.048 173.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -83.53 124.73 31.04 Favored 'General case' 0 N--CA 1.41 -2.437 0 CA-C-N 114.357 -1.292 . . . . 0.0 109.902 -170.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.584 ' HG ' ' H ' ' A' ' 4' ' ' LEU . 1.5 mm? -71.89 -30.94 65.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.264 -175.489 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 127' ' ' TYR . . . . . 0.523 ' CD1' ' HB3' ' A' ' 15' ' ' ASP . 20.0 m-85 -93.2 85.46 5.05 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 122.391 1.091 . . . . 0.0 112.527 176.294 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 51.6 p-80 -140.17 139.17 35.66 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 103.528 -2.768 . . . . 0.0 103.528 176.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.401 ' HB3' ' H ' ' A' ' 130' ' ' THR . 59.6 mm-40 56.78 -155.63 0.31 Allowed 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.698 0.624 . . . . 0.0 109.32 -176.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' THR . . . . . 0.401 ' H ' ' HB3' ' A' ' 129' ' ' GLU . 18.2 m -146.29 138.9 25.36 Favored 'General case' 0 C--N 1.279 -2.486 0 N-CA-C 105.242 -2.133 . . . . 0.0 105.242 172.196 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.593 HD23 ' H ' ' A' ' 131' ' ' LEU . 1.7 pt? -61.93 101.27 0.2 Allowed 'General case' 0 C--O 1.248 1.018 0 CA-C-O 121.924 0.869 . . . . 0.0 109.254 176.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 19.8 m -99.72 159.93 14.68 Favored 'General case' 0 N--CA 1.422 -1.844 0 CA-C-N 114.415 -1.266 . . . . 0.0 110.846 -173.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -116.56 -77.93 0.57 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.174 176.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -146.06 144.03 29.78 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 -178.759 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 47.3 t -91.87 -61.5 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 175.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 85.72 -49.6 4.18 Favored Glycine 0 N--CA 1.442 -0.92 0 CA-C-N 116.042 -0.526 . . . . 0.0 114.055 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 66.53 -82.84 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.921 0.888 . . . . 0.0 109.676 -175.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -151.2 16.79 0.89 Allowed Glycine 0 N--CA 1.433 -1.559 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 176.297 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 . . . . . 0 N--CA 1.436 -1.152 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.489 -178.888 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.0 m . . . . . 0 C--O 1.238 0.47 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.619 ' HA ' ' OH ' ' A' ' 127' ' ' TYR . . . 72.12 138.37 0.05 OUTLIER 'General case' 0 C--N 1.353 0.725 0 C-N-CA 124.616 1.166 . . . . 0.0 112.893 177.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt 74.22 137.24 0.06 Allowed 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 122.11 0.957 . . . . 0.0 113.434 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.466 ' H ' ' CD2' ' A' ' 126' ' ' LEU . 3.6 mp -115.83 -159.35 0.71 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.409 -1.269 . . . . 0.0 107.792 -177.611 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -94.31 145.03 25.03 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 118.419 0.554 . . . . 0.0 111.189 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 71.0 m -113.25 164.08 16.55 Favored Pre-proline 0 C--N 1.301 -1.511 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.475 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 38.5 Cg_exo -60.75 157.67 36.6 Favored 'Trans proline' 0 C--N 1.368 1.573 0 C-N-CA 121.448 1.432 . . . . 0.0 110.956 174.028 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -44.13 -45.35 8.17 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -92.47 2.18 56.82 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.513 -172.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.475 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 23.9 m95 -99.98 126.87 46.22 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.793 0.806 . . . . 0.0 111.788 -173.781 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.2 tp -84.69 119.41 25.22 Favored 'General case' 0 N--CA 1.412 -2.347 0 CA-C-N 113.753 -1.567 . . . . 0.0 108.081 -175.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.6 t -92.72 130.79 38.23 Favored 'General case' 0 C--N 1.272 -2.781 0 CA-C-O 120.897 0.38 . . . . 0.0 111.092 -173.078 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.459 ' CE1' ' HG2' ' A' ' 14' ' ' ARG . 48.3 t-80 -153.31 130.03 10.83 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 123.212 0.605 . . . . 0.0 109.696 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.459 ' HG2' ' CE1' ' A' ' 13' ' ' HIS . 24.0 mmt180 65.11 -81.04 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.439 1.495 . . . . 0.0 113.011 178.677 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -157.77 26.07 0.27 Allowed 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 -174.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -141.98 163.75 32.03 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.441 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.676 ' SG ' HD13 ' A' ' 126' ' ' LEU . 13.1 m -123.96 131.07 53.51 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 176.402 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.432 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 22.6 m-85 -111.15 135.73 51.23 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 120.999 0.428 . . . . 0.0 111.907 -175.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -121.53 102.08 8.02 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 173.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -81.1 95.18 2.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.753 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 9.4 m -77.77 108.03 10.71 Favored 'General case' 0 N--CA 1.414 -2.248 0 CA-C-N 115.416 -0.811 . . . . 0.0 108.98 -178.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 20.8 mm-40 -83.34 14.79 3.34 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.997 0.919 . . . . 0.0 112.67 -179.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.472 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.4 m -105.7 158.89 6.02 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.801 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 178.52 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -111.4 148.38 33.18 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -171.815 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -158.15 -176.69 6.06 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 127.379 2.272 . . . . 0.0 107.825 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.7 p -84.68 176.62 8.45 Favored 'General case' 0 C--O 1.258 1.525 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 171.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.9 t90 -63.02 -47.0 84.93 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.443 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 43.1 mt-10 -67.76 -38.01 82.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.946 -177.013 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.33 -46.07 85.13 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.456 -0.498 . . . . 0.0 111.429 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.9 -35.66 92.33 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 120.165 -1.017 . . . . 0.0 111.574 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 3.2 tm? -55.39 -52.16 64.45 Favored 'General case' 0 C--O 1.249 1.043 0 C-N-CA 123.797 0.839 . . . . 0.0 108.999 176.005 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 84.8 t -68.1 -32.59 56.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.971 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.8 -36.35 80.86 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.783 177.179 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.0 m -69.38 -40.37 77.47 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -60.44 -29.42 69.0 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.369 0.604 . . . . 0.0 109.589 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -60.76 -30.24 72.16 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.248 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -96.8 1.86 51.21 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 117.245 0.522 . . . . 0.0 111.027 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.0 53.28 9.55 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 108.53 -1.828 . . . . 0.0 108.53 -172.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -147.3 177.28 9.34 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.437 ' HB ' HD11 ' A' ' 80' ' ' ILE . 11.2 p -120.85 159.56 25.24 Favored 'General case' 0 C--N 1.284 -2.28 0 C-N-CA 122.917 0.487 . . . . 0.0 110.402 -176.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.7 tp -73.97 131.62 41.59 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 174.635 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.4 tpt -29.38 122.7 0.15 Allowed 'General case' 0 N--CA 1.506 2.333 0 N-CA-C 116.77 2.137 . . . . 0.0 116.77 -170.392 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.481 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 2.9 mm? -112.94 108.09 16.89 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.552 HD13 HD11 ' A' ' 50' ' ' LEU . 54.4 mt -83.38 118.15 30.43 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.7 0 O-C-N 122.211 -0.305 . . . . 0.0 110.556 -175.617 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -79.73 -45.79 18.26 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.16 -178.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -154.15 179.85 8.56 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -174.293 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.3 -36.27 79.08 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -60.3 -27.89 67.67 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.498 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -68.17 -52.13 38.05 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.152 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.554 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.4 mt -66.22 -24.26 66.58 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -64.71 -35.93 82.65 Favored 'General case' 0 N--CA 1.393 -3.285 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -72.1 -31.74 66.34 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.265 175.198 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.607 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.4 mm? -64.21 -52.67 57.69 Favored 'General case' 0 C--O 1.192 -1.922 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.922 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 45.4 mt -54.77 -40.63 69.59 Favored 'General case' 0 C--O 1.252 1.233 0 C-N-CA 123.178 0.591 . . . . 0.0 112.246 -177.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -70.2 -36.8 74.85 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 178.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.8 p -81.96 -33.55 30.19 Favored 'General case' 0 C--N 1.31 -1.152 0 C-N-CA 120.824 -0.351 . . . . 0.0 111.451 -178.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.1 mm -56.07 -45.97 80.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.609 0 C-N-CA 123.878 0.871 . . . . 0.0 109.545 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? 66.12 -68.64 0.13 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.435 1.094 . . . . 0.0 113.093 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -60.36 -38.64 84.5 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 124.656 1.183 . . . . 0.0 114.182 -174.222 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.536 ' H ' HG22 ' A' ' 57' ' ' ILE . 41.8 mmtm 71.94 -53.34 0.69 Allowed 'General case' 0 C--O 1.212 -0.913 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 175.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -67.3 35.16 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 126.321 1.848 . . . . 0.0 114.494 -171.785 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.472 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 14.0 m120 -127.49 -173.61 2.96 Favored 'General case' 0 C--N 1.273 -2.749 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 177.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.681 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 50.2 m -142.66 121.9 13.03 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 177.301 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.472 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 3.0 m-85 -123.64 117.6 25.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -176.463 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.403 ' CE2' ' HB2' ' A' ' 118' ' ' ASN . 78.9 m95 -60.77 139.02 58.05 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 123.53 0.732 . . . . 0.0 111.207 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -119.48 176.25 3.53 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 170.51 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.517 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.94 48.41 2.7 Favored Glycine 0 C--O 1.22 -0.745 0 CA-C-N 118.736 0.698 . . . . 0.0 114.128 -174.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.452 HD21 HD13 ' A' ' 85' ' ' LEU . 48.3 mt -113.1 115.42 28.28 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 123.295 0.638 . . . . 0.0 112.105 -179.046 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -126.22 146.81 49.83 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 173.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.458 ' CZ ' HD21 ' A' ' 72' ' ' LEU . 30.0 t80 -96.37 113.19 24.76 Favored 'General case' 0 C--N 1.277 -2.582 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -177.111 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 17.1 p -107.2 127.66 53.72 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.69 -175.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.458 HD21 ' CZ ' ' A' ' 70' ' ' TYR . 86.1 mt -120.09 150.59 51.48 Favored Pre-proline 0 C--N 1.305 -1.359 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -85.11 141.75 32.95 Favored 'Cis proline' 0 C--O 1.24 0.599 0 C-N-CA 123.996 -1.252 . . . . 0.0 111.581 -3.031 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.413 ' OD2' ' HB2' ' A' ' 76' ' ' ASN . 22.0 t70 174.48 -36.34 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.3 mpt? 63.82 15.41 9.04 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 113.418 -1.719 . . . . 0.0 113.707 176.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ASN . . . . . 0.413 ' HB2' ' OD2' ' A' ' 74' ' ' ASP . 86.3 m-20 -124.71 165.62 17.62 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 174.17 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -92.62 138.14 31.76 Favored 'General case' 0 C--N 1.281 -2.399 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -177.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -118.87 152.42 36.31 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.611 ' HB2' ' OD1' ' A' ' 81' ' ' ASN . 23.7 m95 -98.2 170.76 8.66 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 115.463 -0.79 . . . . 0.0 108.909 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.437 HD11 ' HB ' ' A' ' 40' ' ' THR . 48.1 pt -73.23 -12.33 15.47 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.882 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.611 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 33.3 p-10 -86.17 -8.08 58.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.243 0.544 . . . . 0.0 109.665 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.39 6.48 57.54 Favored Glycine 0 CA--C 1.523 0.577 0 CA-C-N 114.903 -1.044 . . . . 0.0 113.473 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.5 t -96.05 174.16 7.06 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -178.286 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 59.3 m -106.55 145.55 31.72 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 121.256 0.551 . . . . 0.0 109.864 177.138 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.52 HD11 HD12 ' A' ' 92' ' ' ILE . 28.4 tp -54.23 144.21 20.77 Favored 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 125.987 1.715 . . . . 0.0 113.41 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -92.34 89.83 6.99 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 170.192 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.8 m -70.37 -12.24 61.45 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.486 -175.578 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -77.66 -10.66 59.64 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.435 -176.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.4 m -75.46 -51.28 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -176.083 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.0 mt -155.21 -177.96 6.91 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -173.557 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.413 ' HD2' ' HB3' ' A' ' 108' ' ' LYS . 0.0 OUTLIER -63.98 102.67 0.51 Allowed 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 114.72 1.378 . . . . 0.0 114.72 -179.064 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.52 HD12 HD11 ' A' ' 85' ' ' LEU . 7.7 mt -143.47 98.65 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 171.096 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.1 m -60.49 127.69 32.95 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.364 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.96 -43.8 5.89 Favored Glycine 0 N--CA 1.414 -2.808 0 N-CA-C 108.78 -1.728 . . . . 0.0 108.78 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -85.96 85.44 7.37 Favored 'General case' 0 N--CA 1.428 -1.575 0 CA-C-O 122.727 1.251 . . . . 0.0 110.925 177.802 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.1 t -122.16 -32.33 3.7 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.394 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 56.06 34.36 23.62 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.935 0.894 . . . . 0.0 111.811 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ASN . . . . . 0.442 ' O ' ' HD2' ' A' ' 70' ' ' TYR . 35.1 m-80 -108.57 -171.7 1.91 Allowed 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.829 176.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -119.52 25.75 9.85 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-O 123.019 1.39 . . . . 0.0 107.299 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.424 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 22.9 t -73.9 157.65 35.89 Favored 'General case' 0 C--N 1.298 -1.65 0 CA-C-N 113.854 -1.521 . . . . 0.0 111.544 -174.323 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 72.2 m -121.59 144.89 48.48 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ALA . . . . . 0.455 ' HA ' ' HA ' ' A' ' 111' ' ' PHE . . . -95.31 150.48 20.21 Favored 'General case' 0 C--O 1.251 1.15 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -173.883 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.19 154.43 43.85 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 124.571 1.148 . . . . 0.0 109.664 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.681 ' O ' ' HA ' ' A' ' 63' ' ' SER . 14.1 mm -77.65 116.27 20.87 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.354 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 173.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 6.4 t -129.3 93.11 3.49 Favored 'General case' 0 N--CA 1.405 -2.685 0 N-CA-C 106.749 -1.574 . . . . 0.0 106.749 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 87.79 -133.51 11.85 Favored Glycine 0 N--CA 1.431 -1.668 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' ASP . . . . . 0.487 ' OD2' ' HE2' ' A' ' 60' ' ' LYS . 8.1 m-20 -97.73 15.05 24.79 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 174.272 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' LYS . . . . . 0.413 ' HB3' ' HD2' ' A' ' 91' ' ' LYS . 29.8 mmtp -125.38 168.99 12.79 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.706 -174.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.2 t -115.53 133.32 62.25 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.003 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 173.48 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.7 p -129.15 167.79 17.08 Favored 'General case' 0 C--N 1.278 -2.514 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.455 ' HA ' ' HA ' ' A' ' 102' ' ' ALA . 6.2 p90 -122.74 128.08 50.04 Favored 'General case' 0 C--N 1.285 -2.234 0 CA-C-O 121.444 0.64 . . . . 0.0 111.105 176.78 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.401 ' HB2' ' CH2' ' A' ' 65' ' ' TRP . 21.4 mm-40 -120.81 170.02 9.86 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.805 -172.402 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.9 m -65.78 128.41 35.89 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 170.25 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 11.7 m -61.21 -18.91 60.64 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.242 0.617 . . . . 0.0 112.292 -172.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -88.84 0.16 56.8 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.935 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 64.7 p -80.32 150.09 30.05 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.989 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -76.76 106.15 8.25 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.142 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' ASN . . . . . 0.403 ' HB2' ' CE2' ' A' ' 65' ' ' TRP . 78.2 m-20 -143.67 172.46 12.79 Favored 'General case' 0 CA--C 1.489 -1.372 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.753 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.6 mpt_? -93.74 -174.82 3.56 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 -177.398 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 24.4 p90 -155.36 167.56 29.98 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 119.897 1.226 . . . . 0.0 111.619 -177.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.45 HD13 HD12 ' A' ' 53' ' ' LEU . 79.5 mt -124.06 123.55 66.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-O 121.234 0.54 . . . . 0.0 110.052 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 79.0 m -100.84 138.93 37.23 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.103 176.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.552 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 1.9 pt20 -123.43 140.49 52.95 Favored 'General case' 0 N--CA 1.413 -2.293 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 173.3 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -109.5 124.31 50.86 Favored 'General case' 0 C--N 1.246 -3.91 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 175.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 127' ' ' TYR . 41.1 tt0 -72.22 114.22 10.1 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 177.166 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.676 HD13 ' SG ' ' A' ' 17' ' ' CYS . 13.6 tp -72.83 -24.15 60.86 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 114.274 -1.33 . . . . 0.0 110.224 -171.03 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 127' ' ' TYR . . . . . 0.619 ' OH ' ' HA ' ' A' ' 2' ' ' ALA . 33.4 m-85 -94.89 116.75 29.1 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.964 172.917 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -99.8 43.55 1.05 Allowed 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -173.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLU . . . . . 0.445 ' HG2' ' HB3' ' A' ' 127' ' ' TYR . 10.8 mm-40 -75.07 69.77 2.0 Allowed 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.252 1.025 . . . . 0.0 111.96 -174.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 61.0 m -160.59 -51.55 0.05 OUTLIER 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 105.955 -1.868 . . . . 0.0 105.955 176.63 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.4 mt -99.7 23.02 10.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 177.537 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 10.2 p -73.71 110.9 8.37 Favored 'General case' 0 N--CA 1.418 -2.037 0 CA-C-N 113.936 -1.484 . . . . 0.0 109.151 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 66.6 -83.25 0.03 OUTLIER 'General case' 0 CA--C 1.489 -1.382 0 C-N-CA 124.273 1.029 . . . . 0.0 111.216 -175.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -142.58 142.58 32.18 Favored 'General case' 0 N--CA 1.42 -1.945 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -174.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 43.3 t -88.09 -23.71 6.39 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.613 0 CA-C-O 121.729 0.776 . . . . 0.0 109.013 179.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 91.73 44.48 4.22 Favored Glycine 0 N--CA 1.431 -1.668 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.015 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -68.66 147.36 52.0 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.208 0.527 . . . . 0.0 110.837 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 120.63 -27.05 6.69 Favored Glycine 0 C--N 1.293 -1.85 0 N-CA-C 109.611 -1.395 . . . . 0.0 109.611 -178.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 57.2 t-80 . . . . . 0 C--O 1.243 0.746 0 C-N-CA 124.266 1.027 . . . . 0.0 110.36 179.648 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 CA--C 1.551 0.981 0 CA-C-O 121.435 0.636 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.67 96.47 6.52 Favored 'General case' 0 N--CA 1.434 -1.242 0 O-C-N 121.857 -0.527 . . . . 0.0 109.894 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 15.5 mtpt -37.46 145.88 0.06 Allowed 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 126.482 1.913 . . . . 0.0 114.999 174.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.524 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 4.8 mp -107.86 -154.91 0.54 Allowed 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 173.902 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -86.71 141.03 29.2 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 118.621 0.646 . . . . 0.0 112.178 -177.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.9 m -120.68 156.06 56.41 Favored Pre-proline 0 C--N 1.309 -1.186 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.955 177.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.492 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 15.4 Cg_exo -66.36 164.41 28.45 Favored 'Trans proline' 0 CA--C 1.55 1.279 0 C-N-CA 121.733 1.622 . . . . 0.0 111.344 174.445 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLN . . . . . 0.425 ' HG3' ' N ' ' A' ' 9' ' ' ASP . 11.4 pt20 -50.73 -46.1 58.92 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -173.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.425 ' N ' ' HG3' ' A' ' 8' ' ' GLN . 22.4 m-20 -92.74 24.29 3.67 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 120.749 0.309 . . . . 0.0 111.282 -173.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.492 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 26.6 m95 -122.17 131.98 54.22 Favored 'General case' 0 C--N 1.295 -1.802 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.527 -177.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.35 135.97 33.12 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 177.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.1 t -98.48 123.3 42.55 Favored 'General case' 0 C--N 1.292 -1.92 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.112 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.404 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 43.0 t-80 -130.39 108.15 9.77 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.938 -0.476 . . . . 0.0 110.949 179.147 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.533 ' O ' ' HG3' ' A' ' 3' ' ' LYS . 42.0 mtm180 59.59 -68.63 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 126.451 1.901 . . . . 0.0 113.642 177.236 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -147.8 19.66 1.15 Allowed 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.427 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.583 ' HG3' ' HA ' ' A' ' 125' ' ' GLU . 3.9 mppt? -150.87 151.99 33.03 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.231 0.612 . . . . 0.0 109.926 176.672 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.698 ' SG ' HD13 ' A' ' 126' ' ' LEU . 8.3 m -108.22 136.71 47.43 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 177.507 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.424 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 13.6 m-85 -113.27 142.0 46.34 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 118.669 0.668 . . . . 0.0 111.546 -176.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' HIS . . . . . 0.443 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 60.8 t-80 -128.15 112.57 14.7 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 175.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.8 t -94.12 98.57 8.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.163 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.762 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 4.8 m -77.69 117.86 19.5 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 84.7 mm-40 -86.97 14.39 7.46 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.855 0.836 . . . . 0.0 111.726 179.711 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.499 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 7.2 m -111.44 156.31 12.61 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.295 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 55.1 m -103.51 158.98 15.98 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -173.258 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 36.5 m-20 -162.96 170.98 17.25 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 127.716 2.407 . . . . 0.0 107.896 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.7 p -81.64 165.62 20.9 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 170.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -58.42 -50.95 71.86 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.737 0.699 . . . . 0.0 112.051 -174.53 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.443 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 38.6 mt-10 -66.26 -32.01 73.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.596 0.712 . . . . 0.0 110.793 -176.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -70.42 -44.56 67.65 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.454 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.33 -35.22 91.77 Favored Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 2.7 tm? -55.68 -52.26 64.45 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.77 -35.06 74.27 Favored 'Isoleucine or valine' 0 C--O 1.244 0.778 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.68 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.05 -36.5 81.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.726 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.6 m -67.44 -42.6 82.86 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 176.557 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.75 -23.11 67.03 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.217 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.96 -33.91 87.12 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.169 176.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -93.94 10.22 34.26 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.284 -0.539 . . . . 0.0 110.056 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 40.85 84.52 Favored Glycine 0 CA--C 1.495 -1.176 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.547 ' HB1' ' O ' ' A' ' 123' ' ' GLN . . . -131.28 176.79 7.99 Favored 'General case' 0 N--CA 1.416 -2.125 0 CA-C-N 114.723 -0.738 . . . . 0.0 109.29 -176.321 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -117.62 162.14 18.51 Favored 'General case' 0 C--N 1.284 -2.269 0 C-N-CA 123.24 0.616 . . . . 0.0 109.571 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.3 tp -81.1 121.95 26.73 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.8 tpt -21.05 118.42 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 117.291 2.33 . . . . 0.0 117.291 -168.633 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.467 HD23 ' NE2' ' A' ' 123' ' ' GLN . 3.2 mm? -112.09 105.9 14.39 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.816 1.246 . . . . 0.0 108.127 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.414 ' HB ' ' CH2' ' A' ' 79' ' ' TRP . 24.2 mt -93.73 130.43 42.71 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -175.406 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -110.08 -26.36 9.73 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.994 176.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.426 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 14.6 t70 -136.96 167.25 21.85 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.291 -173.443 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -37.55 75.02 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.162 0.985 . . . . 0.0 108.556 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 6.6 pt-20 -60.3 -27.29 67.19 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-O 121.197 0.522 . . . . 0.0 110.688 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.426 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 1.6 mt-10 -63.54 -54.62 33.26 Favored 'General case' 0 N--CA 1.422 -1.842 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.644 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 51.2 mt -68.44 -27.73 66.44 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.585 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 16.5 ptt180 -66.02 -34.81 78.95 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.564 -0.854 . . . . 0.0 108.901 177.102 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -72.44 -33.69 67.25 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 177.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.659 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -61.11 -49.46 77.21 Favored 'General case' 0 CA--C 1.48 -1.717 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 54.2 mt -56.18 -34.51 66.28 Favored 'General case' 0 C--N 1.314 -0.951 0 O-C-N 123.563 0.539 . . . . 0.0 112.092 -178.664 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.69 -44.58 85.75 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.86 0.362 . . . . 0.0 110.66 175.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 35.1 p -76.6 -27.55 55.81 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.019 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 53' ' ' LEU . 42.9 mm -66.79 -55.77 16.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.6 tptm 66.05 -63.23 0.24 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.855 1.262 . . . . 0.0 113.492 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -65.52 -39.93 92.37 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 122.69 0.396 . . . . 0.0 111.583 -175.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.557 ' H ' HG22 ' A' ' 57' ' ' ILE . 94.6 mttt 70.99 -47.3 0.65 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 173.219 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -67.3 -1.0 3.98 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 115.359 1.615 . . . . 0.0 115.359 -170.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.592 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 61.7 m-80 -82.04 -160.98 0.4 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.215 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 18.9 m -142.63 114.03 7.85 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.592 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 2.7 m-85 -121.61 118.52 29.41 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 117.636 0.198 . . . . 0.0 110.696 -175.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' TRP . . . . . 0.4 ' CH2' ' HB2' ' A' ' 112' ' ' GLU . 74.9 m95 -62.33 142.91 57.54 Favored 'General case' 0 C--N 1.312 -1.048 0 C-N-CA 123.239 0.616 . . . . 0.0 112.018 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.15 176.28 4.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 168.106 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.585 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.15 47.06 2.55 Favored Glycine 0 C--O 1.217 -0.92 0 CA-C-N 118.71 0.686 . . . . 0.0 114.309 -174.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.9 mt -112.13 118.56 35.69 Favored 'General case' 0 CA--C 1.494 -1.184 0 C-N-CA 123.818 0.847 . . . . 0.0 111.209 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -127.39 136.08 51.36 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.08 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -90.46 112.7 24.43 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 177.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.594 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 1.4 p -92.65 115.56 28.22 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.04 -175.184 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 71' ' ' THR . 40.0 mt -120.83 140.59 30.96 Favored Pre-proline 0 C--N 1.318 -0.778 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.439 175.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -83.69 130.69 16.3 Favored 'Cis proline' 0 C--O 1.245 0.838 0 C-N-CA 123.445 -1.481 . . . . 0.0 110.845 -3.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.594 ' HB3' ' O ' ' A' ' 71' ' ' THR . 13.4 t70 176.89 -44.2 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 -174.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.516 ' HG2' ' OE1' ' A' ' 97' ' ' GLU . 83.2 mtp 70.41 21.98 5.45 Favored 'General case' 0 CA--C 1.497 -1.069 0 CA-C-N 114.387 -1.279 . . . . 0.0 114.174 173.024 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -117.32 157.26 26.41 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.575 174.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -94.01 107.05 19.0 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 171.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -105.28 145.98 29.96 Favored 'General case' 0 C--N 1.275 -2.64 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.807 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.585 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 47.8 m95 -87.25 165.02 15.98 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 176.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 47.0 pt -67.19 -17.83 23.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.515 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 32.7 p-10 -85.9 -9.59 56.68 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.171 0.51 . . . . 0.0 109.742 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.75 8.23 55.95 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.649 -0.705 . . . . 0.0 114.234 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.2 t -85.37 174.8 9.29 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 117.537 0.668 . . . . 0.0 109.911 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 88.0 m -101.18 140.68 35.14 Favored 'General case' 0 N--CA 1.42 -1.944 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.615 HD11 HD12 ' A' ' 92' ' ' ILE . 40.8 tp -53.92 132.56 42.21 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 178.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -92.47 81.86 4.87 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 170.657 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.4 p -71.74 -11.99 61.09 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.361 0.601 . . . . 0.0 111.19 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -77.34 -1.45 30.0 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.664 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 33.7 m -80.7 -47.69 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.446 174.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.408 ' HB2' HG23 ' A' ' 109' ' ' VAL . 95.5 mt -154.86 177.79 10.89 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.528 0.731 . . . . 0.0 109.147 -175.3 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -67.52 117.05 8.94 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -175.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.615 HD12 HD11 ' A' ' 85' ' ' LEU . 8.8 mt -149.86 114.57 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 172.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.7 m -69.88 128.66 37.15 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -81.45 -30.69 35.95 Favored Glycine 0 N--CA 1.418 -2.503 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -174.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -112.7 117.37 32.04 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.5 t -142.73 -19.89 0.67 Allowed 'General case' 0 C--N 1.289 -2.025 0 C-N-CA 119.041 -1.064 . . . . 0.0 111.199 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . 0.516 ' OE1' ' HG2' ' A' ' 75' ' ' MET . 10.2 mm-40 49.86 64.77 1.64 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.732 0.777 . . . . 0.0 112.765 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -141.97 167.3 22.46 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.857 -174.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -90.54 29.14 1.34 Allowed 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 126.905 2.082 . . . . 0.0 107.48 175.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' SER . . . . . 0.428 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 21.7 t -91.43 151.24 20.89 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 113.738 -1.574 . . . . 0.0 113.51 -171.089 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 66.8 m -130.87 151.63 51.08 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 174.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -92.76 149.51 21.25 Favored 'General case' 0 C--O 1.251 1.139 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -173.867 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.1 148.15 36.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.396 1.078 . . . . 0.0 110.328 -178.172 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.433 HD11 HD22 ' A' ' 50' ' ' LEU . 12.1 mm -77.07 125.61 37.02 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 C-N-CA 124.348 1.059 . . . . 0.0 108.414 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 8.8 t -149.85 95.34 2.3 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.444 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . 105.51 -143.19 15.65 Favored Glycine 0 C--N 1.296 -1.657 0 N-CA-C 109.083 -1.607 . . . . 0.0 109.083 -178.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -99.03 15.03 27.12 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -128.19 171.3 12.07 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.767 -173.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.408 HG23 ' HB2' ' A' ' 90' ' ' LEU . 10.5 t -104.21 142.46 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.654 0 N-CA-C 105.615 -1.995 . . . . 0.0 105.615 173.804 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.3 p -131.88 175.73 8.96 Favored 'General case' 0 C--N 1.278 -2.508 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 178.055 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' PHE . . . . . 0.428 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 19.4 p90 -138.9 139.04 37.93 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 119.229 0.922 . . . . 0.0 112.743 177.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLU . . . . . 0.4 ' HB2' ' CH2' ' A' ' 65' ' ' TRP . 16.8 mm-40 -125.24 168.5 13.38 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 -177.624 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.0 m -66.9 136.2 55.01 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 174.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 33.8 m -57.62 -16.88 11.71 Favored 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -173.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -95.41 7.95 44.7 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 123.683 0.793 . . . . 0.0 110.491 -173.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 51.1 p -90.67 140.06 30.13 Favored 'General case' 0 N--CA 1.427 -1.576 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.893 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -75.93 106.5 7.55 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.449 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -141.25 172.22 12.98 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 124.077 0.951 . . . . 0.0 108.684 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.762 ' HB3' ' O ' ' A' ' 21' ' ' SER . 4.7 mpt_? -83.3 -179.68 7.45 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 15.3 p90 -154.56 161.95 41.38 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 118.092 -1.443 . . . . 0.0 112.375 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 82.0 mt -119.83 122.25 68.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.415 0.626 . . . . 0.0 110.282 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 79.4 m -100.46 148.81 24.34 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.955 177.081 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.547 ' O ' ' HB1' ' A' ' 39' ' ' ALA . 5.4 pt20 -125.98 139.05 53.75 Favored 'General case' 0 N--CA 1.418 -2.028 0 N-CA-C 106.733 -1.581 . . . . 0.0 106.733 172.306 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -109.51 109.04 19.73 Favored 'General case' 0 C--N 1.259 -3.343 0 N-CA-C 103.699 -2.704 . . . . 0.0 103.699 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.583 ' HA ' ' HG3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -63.72 116.44 5.72 Favored 'General case' 0 N--CA 1.424 -1.747 0 CA-C-O 122.17 0.986 . . . . 0.0 109.406 -176.98 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.698 HD13 ' SG ' ' A' ' 17' ' ' CYS . 12.4 tp -77.35 -35.68 54.4 Favored 'General case' 0 N--CA 1.415 -2.178 0 CA-C-N 113.923 -1.49 . . . . 0.0 108.188 -170.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -86.52 84.83 7.33 Favored 'General case' 0 N--CA 1.426 -1.625 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 168.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 21.6 m80 -74.34 115.88 14.36 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.259 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -81.2 91.03 6.11 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 25.7 m -95.6 -48.85 5.64 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.942 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.3 mt -67.46 136.8 55.2 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.927 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 32.0 t -100.96 120.35 40.04 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -99.85 16.4 23.87 Favored 'General case' 0 CA--C 1.489 -1.392 0 CA-C-O 121.889 0.852 . . . . 0.0 108.996 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -130.19 -176.85 4.08 Favored 'General case' 0 N--CA 1.406 -2.625 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.532 -175.641 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 41.6 t -142.89 67.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 N-CA-C 104.45 -2.426 . . . . 0.0 104.45 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 94.06 -87.3 1.12 Allowed Glycine 0 C--N 1.288 -2.128 0 CA-C-N 113.357 -1.747 . . . . 0.0 110.074 179.187 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -121.0 -72.02 0.71 Allowed 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 174.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -165.53 72.33 0.18 Allowed Glycine 0 N--CA 1.435 -1.392 0 C-N-CA 119.891 -1.147 . . . . 0.0 113.246 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 12.3 p80 . . . . . 0 C--N 1.31 -1.122 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 176.03 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 38.9 m . . . . . 0 C--O 1.244 0.78 0 N-CA-C 111.606 0.225 . . . . 0.0 111.606 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . 0.409 ' HB2' ' CB ' ' A' ' 12' ' ' SER . . . -99.71 150.58 22.15 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 120.4 0.143 . . . . 0.0 111.077 -177.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.475 ' HA ' ' HE3' ' A' ' 3' ' ' LYS . 2.2 tpmt? -77.64 -63.94 1.26 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 122.604 1.192 . . . . 0.0 109.376 174.422 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.417 HD13 ' HG ' ' A' ' 126' ' ' LEU . 3.9 mp -99.82 -149.79 0.37 Allowed 'General case' 0 C--N 1.273 -2.724 0 N-CA-C 105.53 -2.026 . . . . 0.0 105.53 174.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -115.74 139.34 50.25 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 119.764 1.165 . . . . 0.0 112.25 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.5 m -101.4 157.06 34.39 Favored Pre-proline 0 C--N 1.303 -1.449 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.904 -177.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -64.98 164.18 25.78 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 121.713 1.609 . . . . 0.0 111.667 175.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -49.66 -44.57 47.82 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -176.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -80.83 15.43 1.78 Allowed 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -125.85 153.77 43.64 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.468 -0.77 . . . . 0.0 112.712 -172.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -94.83 -176.69 3.94 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 169.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.409 ' CB ' ' HB2' ' A' ' 2' ' ' ALA . 28.5 p -148.22 140.99 24.63 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 120.248 -0.581 . . . . 0.0 111.605 -179.551 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -148.96 108.31 3.95 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 176.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 70.29 -85.35 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 125.366 1.466 . . . . 0.0 111.524 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -138.52 27.65 2.5 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.789 -174.916 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -145.57 157.23 44.01 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 176.404 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.644 ' SG ' HD13 ' A' ' 126' ' ' LEU . 7.6 m -112.69 140.79 47.17 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.008 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -116.63 145.77 43.17 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 118.801 0.728 . . . . 0.0 111.44 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -137.52 106.57 5.99 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.217 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.5 t -90.05 101.59 12.39 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.793 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.066 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.709 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 5.5 m -78.13 111.17 13.77 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -79.01 14.73 1.3 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.77 0.828 . . . . 0.0 113.027 -178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.583 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 15.6 m -111.65 156.11 12.84 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 m -102.54 141.9 34.6 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -171.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -152.39 169.73 21.83 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 128.084 2.554 . . . . 0.0 106.842 -179.113 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 38.2 p -80.45 169.88 17.11 Favored 'General case' 0 C--O 1.253 1.278 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 169.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TRP . . . . . 0.473 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 92.9 t90 -57.42 -49.04 77.49 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.743 0.306 . . . . 0.0 111.314 -176.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.05 -35.14 79.21 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.444 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -61.73 -47.77 83.74 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 120.519 0.199 . . . . 0.0 110.715 176.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.4 -35.87 92.63 Favored Glycine 0 CA--C 1.504 -0.631 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.252 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.99 -50.94 72.19 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 96.7 t -64.14 -32.99 59.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.504 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.19 -36.69 84.48 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.945 175.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 60.5 m -68.04 -39.78 83.01 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.43 -33.16 69.39 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 121.162 0.505 . . . . 0.0 109.842 176.38 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -60.03 -28.3 66.1 Favored Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 114.914 -1.039 . . . . 0.0 113.517 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -99.37 5.8 46.28 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 117.346 0.573 . . . . 0.0 110.302 177.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.5 49.94 41.02 Favored Glycine 0 N--CA 1.44 -1.046 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -174.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.28 177.38 9.05 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -118.88 165.59 13.87 Favored 'General case' 0 C--N 1.29 -2.014 0 C-N-CA 122.623 0.369 . . . . 0.0 110.587 -178.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.7 tp -77.54 132.02 38.15 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 18.1 tpt -30.38 121.93 0.19 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.449 HD12 ' HB3' ' A' ' 79' ' ' TRP . 2.6 mm? -114.39 98.64 7.04 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.124 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.502 HD13 HD21 ' A' ' 50' ' ' LEU . 40.8 mt -79.04 123.33 35.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -177.238 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 71.9 mm-40 -100.36 -20.63 15.75 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 120.055 -0.658 . . . . 0.0 112.45 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.512 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 21.3 t70 -159.72 169.69 23.14 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -174.715 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -73.34 -21.32 60.57 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 117.942 0.337 . . . . 0.0 110.781 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.471 ' HB2' ' OD2' ' A' ' 46' ' ' ASP . 0.5 OUTLIER -57.85 -34.41 69.7 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 123.847 0.859 . . . . 0.0 109.109 175.365 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.512 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 3.5 mm-40 -63.16 -55.04 28.54 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.296 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.636 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 79.6 mt -65.8 -24.81 67.0 Favored 'General case' 0 CA--C 1.496 -1.126 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -63.32 -44.93 93.53 Favored 'General case' 0 N--CA 1.402 -2.835 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -73.0 -25.28 60.92 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.654 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.674 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -63.52 -51.39 65.71 Favored 'General case' 0 C--O 1.184 -2.377 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.32 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 39.4 mt -51.96 -40.51 60.97 Favored 'General case' 0 C--N 1.311 -1.077 0 O-C-N 123.882 0.739 . . . . 0.0 111.562 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.34 -40.1 95.2 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.092 176.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.3 p -85.61 -9.69 56.93 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.468 0.651 . . . . 0.0 111.793 -179.126 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.8 mm -83.54 -52.4 13.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.083 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? 68.24 -69.86 0.14 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.209 1.004 . . . . 0.0 112.732 -178.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -59.12 -59.92 4.7 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 123.049 0.539 . . . . 0.0 111.895 -175.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.437 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 45.9 mtmt 75.03 -10.83 1.15 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.81 1.244 . . . . 0.0 112.772 -177.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -77.54 -21.95 51.83 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.682 0.277 . . . . 0.0 111.708 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 30.2 m-80 -78.84 -169.62 1.84 Allowed 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 15.9 m -140.96 122.97 15.53 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.592 -1.632 . . . . 0.0 106.592 178.113 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.8 m-85 -124.5 120.21 31.36 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -174.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -63.57 137.75 58.24 Favored 'General case' 0 C--N 1.311 -1.107 0 O-C-N 123.64 0.587 . . . . 0.0 111.451 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.67 175.13 2.86 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 168.766 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.584 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.53 44.55 2.25 Favored Glycine 0 C--O 1.216 -0.995 0 CA-C-N 118.792 0.724 . . . . 0.0 114.277 -174.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 0.478 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 14.9 mt -113.51 123.81 50.9 Favored 'General case' 0 CA--C 1.486 -1.498 0 C-N-CA 124.154 0.981 . . . . 0.0 111.534 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -133.09 144.66 50.13 Favored 'General case' 0 C--N 1.295 -1.786 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.037 171.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.443 ' OH ' ' HG2' ' A' ' 75' ' ' MET . 82.6 t80 -85.15 128.86 34.83 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.5 p -115.7 128.88 56.22 Favored 'General case' 0 C--N 1.278 -2.52 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -173.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.416 HD23 ' H ' ' A' ' 75' ' ' MET . 43.1 mt -120.76 149.55 50.82 Favored Pre-proline 0 N--CA 1.435 -1.179 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -87.01 125.91 8.44 Favored 'Cis proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.539 -1.442 . . . . 0.0 112.517 -2.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 p30 171.58 -33.45 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.746 1.618 . . . . 0.0 110.008 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.443 ' HG2' ' OH ' ' A' ' 70' ' ' TYR . 83.2 mtp 70.71 22.62 4.83 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 123.819 0.7 . . . . 0.0 111.626 176.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 87.9 m-20 -107.45 155.37 20.12 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.442 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -103.29 118.47 36.84 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -125.58 157.29 37.52 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.509 177.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.584 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.0 m95 -95.62 165.76 12.17 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.02 -178.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 pt -67.11 -17.03 22.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.464 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 26.7 p-10 -86.26 -15.98 39.05 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.11 8.49 36.09 Favored Glycine 0 C--N 1.317 -0.523 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.665 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.7 m -80.0 162.39 24.91 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 122.617 0.367 . . . . 0.0 111.304 175.443 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 27.1 m -99.93 140.57 33.96 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.465 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 48.9 tp -68.21 133.21 48.49 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -89.26 91.07 8.62 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 167.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.2 m -70.99 -7.99 50.1 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.599 -177.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -77.75 -4.46 46.45 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.6 m -75.11 -52.95 17.4 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 118.646 -1.221 . . . . 0.0 110.939 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.5 mt -144.29 -178.44 5.97 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -176.455 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.411 ' HB2' ' HE3' ' A' ' 91' ' ' LYS . 18.8 ptmt -69.41 111.53 5.35 Favored 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -177.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.425 HD12 HD21 ' A' ' 85' ' ' LEU . 9.4 mt -146.67 120.18 2.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.239 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 173.196 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 95' ' ' ASP . 8.0 m -101.42 138.22 38.71 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 120.631 0.253 . . . . 0.0 110.6 -173.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -95.18 -15.29 45.21 Favored Glycine 0 N--CA 1.432 -1.624 0 N-CA-C 109.864 -1.294 . . . . 0.0 109.864 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ASP . . . . . 0.419 ' H ' HG22 ' A' ' 93' ' ' THR . 4.2 m-20 -83.03 114.79 21.52 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 174.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.0 t -170.18 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.61 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 67.64 17.3 9.89 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -177.692 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -102.41 -171.33 1.94 Allowed 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -118.31 26.63 9.48 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 105.908 -1.886 . . . . 0.0 105.908 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 32.3 t -66.2 158.87 27.69 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 112.302 -2.226 . . . . 0.0 113.654 -172.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -135.1 154.56 51.63 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 124.831 1.253 . . . . 0.0 108.074 175.534 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -97.61 150.58 20.98 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -172.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -142.51 146.49 34.75 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 114.633 -1.167 . . . . 0.0 109.926 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.513 ' O ' ' HA ' ' A' ' 63' ' ' SER . 8.7 mm -77.44 126.71 38.13 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 C-N-CA 124.084 0.954 . . . . 0.0 108.585 177.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.2 t -154.36 96.47 1.92 Allowed 'General case' 0 N--CA 1.423 -1.781 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.437 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . 102.72 -144.18 16.03 Favored Glycine 0 N--CA 1.426 -1.969 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -102.85 22.36 13.94 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 174.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -129.91 169.69 14.88 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 114.171 -1.377 . . . . 0.0 107.81 -174.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 20.9 t -111.86 141.01 28.62 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.13 0 N-CA-C 104.864 -2.272 . . . . 0.0 104.864 172.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.1 p -128.89 171.69 12.05 Favored 'General case' 0 C--N 1.277 -2.58 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 18.8 p90 -149.07 139.85 22.76 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 118.739 0.7 . . . . 0.0 112.257 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -147.27 -176.88 5.4 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.335 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.5 m -72.93 125.48 27.67 Favored 'General case' 0 C--N 1.296 -1.739 0 O-C-N 123.378 0.424 . . . . 0.0 110.328 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 77.4 m -47.03 -23.27 0.44 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 126.803 2.041 . . . . 0.0 114.312 -177.692 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 3.4 p-10 -83.03 -1.17 51.98 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.83 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.9 p -80.37 154.33 27.79 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 119.946 -0.701 . . . . 0.0 109.674 172.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -94.41 106.21 18.19 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -175.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -137.51 173.97 11.1 Favored 'General case' 0 C--O 1.204 -1.325 0 C-N-CA 123.179 0.592 . . . . 0.0 110.13 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.709 ' HB3' ' O ' ' A' ' 21' ' ' SER . 3.6 mpt_? -81.95 175.51 10.32 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 -177.763 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 18.9 p90 -149.77 165.81 31.33 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.642 1.11 . . . . 0.0 111.939 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.482 HD13 HD12 ' A' ' 53' ' ' LEU . 70.1 mt -124.61 124.88 69.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.356 0.598 . . . . 0.0 110.892 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 95.8 m -102.61 144.2 31.32 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.41 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.419 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 5.7 pt20 -127.48 139.55 52.73 Favored 'General case' 0 N--CA 1.42 -1.95 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 171.764 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.6 ttmm -110.64 118.25 35.7 Favored 'General case' 0 C--N 1.254 -3.567 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -69.79 118.34 12.52 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 175.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.644 HD13 ' SG ' ' A' ' 17' ' ' CYS . 12.8 tp -72.45 -23.36 61.05 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 114.157 -1.383 . . . . 0.0 109.715 -172.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' TYR . . . . . 0.466 ' CE1' ' HG2' ' A' ' 3' ' ' LYS . 3.5 m-85 -73.36 27.54 0.06 Allowed 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 175.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 36.6 t-80 -74.92 -22.15 58.78 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 168.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 69.01 157.44 0.15 Allowed 'General case' 0 C--N 1.348 0.536 0 C-N-CA 125.996 1.718 . . . . 0.0 114.36 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 m -90.18 99.51 12.52 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' LEU . . . . . 0.485 HD23 ' H ' ' A' ' 131' ' ' LEU . 2.0 pt? -76.08 160.02 30.19 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.322 -177.605 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 19.9 m 71.0 23.85 4.12 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.54 1.136 . . . . 0.0 111.985 176.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 62.76 -88.8 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.44 1.096 . . . . 0.0 111.933 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -147.86 157.23 43.43 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 -177.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 39.9 t -80.19 -33.63 14.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 125.64 -14.03 7.25 Favored Glycine 0 CA--C 1.504 -0.601 0 C-N-CA 120.222 -0.99 . . . . 0.0 112.149 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 99.8 m-85 63.92 -80.07 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.699 1.2 . . . . 0.0 112.876 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -109.07 -0.38 31.59 Favored Glycine 0 N--CA 1.438 -1.169 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.177 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 46.0 t60 . . . . . 0 C--N 1.308 -1.219 0 CA-C-O 118.317 -0.849 . . . . 0.0 108.864 178.848 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.7 t . . . . . 0 C--O 1.248 0.999 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.4 166.92 21.72 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -73.55 164.47 26.61 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 121.479 0.657 . . . . 0.0 112.148 -179.591 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.491 ' O ' ' HG2' ' A' ' 3' ' ' LYS . 4.4 mp -94.02 -166.22 1.46 Allowed 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -87.8 142.92 27.44 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 69.3 m -108.3 162.85 18.45 Favored Pre-proline 0 C--O 1.25 1.087 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.77 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.86 164.81 25.67 Favored 'Trans proline' 0 C--N 1.366 1.481 0 C-N-CA 122.493 2.129 . . . . 0.0 112.584 173.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -56.36 -21.51 25.15 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 125.481 1.512 . . . . 0.0 114.669 -175.478 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -85.17 -11.49 54.91 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 120.949 0.404 . . . . 0.0 110.411 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 37.4 m95 -113.34 158.93 19.96 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -165.618 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -99.38 175.96 5.68 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 169.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . 0.417 ' HB2' ' HG3' ' A' ' 3' ' ' LYS . 33.7 p -139.9 132.39 28.6 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 118.8 0.727 . . . . 0.0 111.34 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' HIS . . . . . 0.469 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 42.8 t-80 -149.57 124.09 9.71 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 122.188 -0.32 . . . . 0.0 111.041 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.51 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 3.0 mmp_? 66.71 -72.58 0.08 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.07 1.348 . . . . 0.0 113.22 175.561 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -158.98 21.37 0.2 Allowed 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 122.79 0.436 . . . . 0.0 110.511 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LYS . . . . . 0.526 ' HG2' ' NE2' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -145.01 148.1 33.36 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.518 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 17' ' ' CYS . . . . . 0.555 ' O ' ' HA ' ' A' ' 123' ' ' GLN . 8.9 m -95.87 146.58 24.45 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 175.472 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' PHE . . . . . 0.469 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 22.3 m-85 -117.9 143.12 46.61 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 118.624 0.647 . . . . 0.0 110.522 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -132.25 107.99 8.94 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 69.0 t -89.67 96.03 5.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.753 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 5.0 m -78.08 108.29 11.26 Favored 'General case' 0 N--CA 1.423 -1.786 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 88.3 mm-40 -80.09 14.75 1.74 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.437 0.637 . . . . 0.0 112.201 178.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.51 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 6.0 m -103.13 150.06 6.92 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.881 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.4 m -106.01 141.55 37.2 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -172.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -154.16 174.39 14.8 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 127.906 2.483 . . . . 0.0 107.061 -176.009 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 114' ' ' CYS . 60.0 p -84.55 163.96 19.04 Favored 'General case' 0 C--O 1.255 1.366 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 169.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.9 t90 -53.19 -46.6 69.07 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.139 0.495 . . . . 0.0 111.852 -177.509 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -64.07 -37.26 86.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.928 -176.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -68.33 -45.44 72.9 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.659 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.92 -34.84 89.08 Favored Glycine 0 CA--C 1.506 -0.502 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.496 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 tt -56.34 -50.99 69.9 Favored 'General case' 0 C--O 1.25 1.092 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 175.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.36 -38.95 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.958 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.47 -40.05 77.71 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 64.6 m -66.26 -39.68 89.63 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.57 -29.26 70.45 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 120.992 0.425 . . . . 0.0 110.838 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.94 -16.59 78.31 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.247 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -92.47 -11.16 35.39 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 177.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.2 31.12 29.14 Favored Glycine 0 N--CA 1.444 -0.825 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 -171.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -129.81 176.98 7.59 Favored 'General case' 0 N--CA 1.42 -1.929 0 CA-C-N 114.755 -0.723 . . . . 0.0 110.096 -174.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' THR . . . . . 0.485 ' HB ' HD11 ' A' ' 80' ' ' ILE . 2.9 p -115.3 157.85 23.21 Favored 'General case' 0 C--N 1.282 -2.329 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.891 178.614 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.9 tp -66.47 140.68 58.03 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 173.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' MET . . . . . 0.431 ' HE3' ' HA ' ' A' ' 44' ' ' ILE . 16.3 tpt -39.31 120.75 1.07 Allowed 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -171.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.1 tp -121.04 90.52 3.34 Favored 'General case' 0 N--CA 1.434 -1.265 0 N-CA-C 106.427 -1.694 . . . . 0.0 106.427 -175.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ILE . . . . . 0.482 HD13 HD11 ' A' ' 50' ' ' LEU . 44.4 mt -67.61 122.74 19.34 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.019 -171.639 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -92.9 -21.85 19.59 Favored 'General case' 0 CA--C 1.552 1.058 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.984 -176.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.58 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 28.3 t70 -173.08 177.64 2.69 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -171.09 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -78.65 -31.06 46.67 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.576 -0.702 . . . . 0.0 111.274 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.415 ' HB2' ' OD2' ' A' ' 46' ' ' ASP . 0.7 OUTLIER -58.37 -30.23 66.62 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 124.052 0.941 . . . . 0.0 108.59 176.291 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLU . . . . . 0.58 ' HB2' ' O ' ' A' ' 46' ' ' ASP . 4.3 mm-40 -61.24 -56.27 22.52 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.429 174.636 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.603 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 79.5 mt -69.58 -28.47 66.0 Favored 'General case' 0 CA--C 1.48 -1.716 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -175.032 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.4 ptt180 -69.97 -34.19 73.05 Favored 'General case' 0 N--CA 1.421 -1.905 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.147 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -73.77 -28.28 61.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 175.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.65 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.0 mm? -61.47 -49.36 77.09 Favored 'General case' 0 C--O 1.182 -2.468 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 173.324 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 37.9 mt -55.35 -35.4 65.18 Favored 'General case' 0 C--N 1.313 -0.996 0 O-C-N 123.236 0.335 . . . . 0.0 111.351 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -68.12 -42.59 79.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.073 176.339 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.2 p -79.51 -24.52 42.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -178.239 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 53' ' ' LEU . 36.4 mm -65.84 -51.36 62.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 174.541 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 49.6 tptt 72.6 -65.67 0.34 Allowed 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.06 0.944 . . . . 0.0 113.472 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -65.06 -55.32 19.55 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 118.633 0.652 . . . . 0.0 112.429 -176.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.555 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 44.5 mtmt 69.44 21.34 6.9 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.429 0.692 . . . . 0.0 110.369 -177.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -120.17 19.7 12.17 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.272 0.558 . . . . 0.0 110.852 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.538 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 27.5 m120 -124.47 -153.8 0.58 Allowed 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' SER . . . . . 0.58 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 5.6 t -149.8 126.97 11.31 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 175.715 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.538 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.1 m-85 -129.57 113.37 14.74 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -175.16 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -57.63 136.76 56.84 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 124.085 0.954 . . . . 0.0 112.29 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -120.68 176.71 3.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 170.629 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLY . . . . . 0.593 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -78.19 56.63 4.02 Favored Glycine 0 C--O 1.204 -1.775 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.814 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.7 mt -125.03 121.07 33.3 Favored 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 122.998 0.519 . . . . 0.0 111.718 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 30.0 ptt180 -128.3 135.42 49.59 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.084 176.845 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -81.33 113.5 19.48 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.4 p -103.4 124.43 48.68 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.848 -174.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.1 mt -119.89 148.5 46.67 Favored Pre-proline 0 C--N 1.313 -0.999 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.333 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -86.0 126.18 9.26 Favored 'Cis proline' 0 C--O 1.237 0.439 0 C-N-CA 123.651 -1.395 . . . . 0.0 110.426 -3.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.4 t70 176.64 -36.04 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -174.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.8 mpt? 64.03 8.62 4.08 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 125.441 1.497 . . . . 0.0 114.174 176.077 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -100.03 159.52 15.02 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 175.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -100.82 122.42 43.4 Favored 'General case' 0 C--N 1.288 -2.074 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -116.82 147.2 42.33 Favored 'General case' 0 C--N 1.291 -1.964 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.183 178.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' TRP . . . . . 0.593 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 16.1 m95 -91.0 178.14 6.09 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 123.951 0.782 . . . . 0.0 109.504 -177.621 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.485 HD11 ' HB ' ' A' ' 40' ' ' THR . 48.6 pt -73.06 -12.46 15.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.028 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ASN . . . . . 0.478 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 31.5 p-10 -95.55 -0.91 51.52 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.802 0.81 . . . . 0.0 109.021 178.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.1 5.58 76.51 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 114.5 -1.227 . . . . 0.0 113.563 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.9 t -81.83 169.4 16.92 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -178.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.2 m -100.04 142.9 30.9 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LEU . . . . . 0.544 HD11 HD12 ' A' ' 92' ' ' ILE . 36.9 tp -54.57 138.87 39.88 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 124.63 1.172 . . . . 0.0 113.233 176.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ASN . . . . . 0.468 ' OD1' HG13 ' A' ' 89' ' ' VAL . 25.9 t-20 -93.57 86.52 5.22 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 170.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 p -73.08 3.83 5.05 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -77.57 -21.78 51.97 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.463 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.468 HG13 ' OD1' ' A' ' 86' ' ' ASN . 32.9 m -78.56 -55.24 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 C-N-CA 120.156 -0.617 . . . . 0.0 112.367 -178.463 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.426 HD12 HD13 ' A' ' 50' ' ' LEU . 94.4 mt -140.29 170.37 15.95 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -175.827 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.415 ' O ' HG12 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -72.97 123.19 23.0 Favored 'General case' 0 CA--C 1.5 -0.963 0 O-C-N 123.876 0.735 . . . . 0.0 112.632 -175.828 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ILE . . . . . 0.544 HD12 HD11 ' A' ' 85' ' ' LEU . 2.4 mt -152.32 99.47 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 N-CA-C 104.733 -2.321 . . . . 0.0 104.733 174.202 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 5.3 m -66.8 136.69 55.84 Favored 'General case' 0 C--N 1.285 -2.21 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.553 -173.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -102.0 26.34 24.68 Favored Glycine 0 CA--C 1.479 -2.203 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -175.025 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -152.44 130.63 11.96 Favored 'General case' 0 N--CA 1.409 -2.515 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 174.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.4 t -169.93 -31.62 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.596 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 65.81 28.54 10.84 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.448 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -105.57 178.63 4.51 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.877 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -96.81 27.75 3.8 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.0 p -63.31 150.35 43.49 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 113.004 -1.907 . . . . 0.0 115.797 -171.93 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -134.03 147.53 50.97 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 113.444 -1.707 . . . . 0.0 106.688 173.686 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.48 151.56 19.27 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -172.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -146.71 147.37 30.9 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.849 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.58 ' O ' ' HA ' ' A' ' 63' ' ' SER . 11.5 mm -76.95 131.06 35.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 107.397 -1.335 . . . . 0.0 107.397 177.569 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 27.9 t -106.68 -71.23 0.76 Allowed 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 175.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' GLY . . . . . 0.555 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . -124.98 -102.22 1.39 Allowed Glycine 0 N--CA 1.413 -2.893 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 178.369 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -98.64 2.47 47.29 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -125.51 162.74 24.22 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.034 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' VAL . . . . . 0.427 ' HB ' HG12 ' A' ' 92' ' ' ILE . 3.8 t -99.37 136.82 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.419 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 174.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.3 p -125.39 166.47 16.51 Favored 'General case' 0 C--N 1.269 -2.917 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.8 p90 -138.85 134.15 32.94 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 118.927 0.785 . . . . 0.0 112.848 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -132.24 179.58 6.03 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.491 -1.231 . . . . 0.0 108.406 -176.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.4 m -78.31 129.22 34.77 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 174.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' CYS . . . . . 0.404 ' O ' ' HB ' ' A' ' 26' ' ' THR . 76.6 m -48.21 -18.94 0.24 Allowed 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 126.591 1.956 . . . . 0.0 115.038 -176.543 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -86.37 -3.99 59.09 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 123.525 0.73 . . . . 0.0 110.559 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.0 p -77.43 149.59 35.1 Favored 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 119.965 -0.694 . . . . 0.0 111.069 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -86.39 93.8 9.21 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.989 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -128.35 174.45 9.3 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 114.804 -1.089 . . . . 0.0 108.523 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ARG . . . . . 0.753 ' HB3' ' O ' ' A' ' 21' ' ' SER . 2.5 mpt_? -93.37 -174.5 3.53 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 -177.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 120' ' ' TRP . . . . . 0.425 ' CH2' HG23 ' A' ' 23' ' ' VAL . 28.8 p90 -152.21 167.56 28.19 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.864 1.211 . . . . 0.0 111.95 -179.338 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 69.9 mt -125.59 129.85 72.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.451 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 75.0 m -110.03 150.98 27.75 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLN . . . . . 0.555 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.3 pt20 -128.25 140.64 51.78 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 171.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -117.27 115.16 24.74 Favored 'General case' 0 C--N 1.277 -2.556 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 125' ' ' GLU . . . . . 0.606 ' CD ' ' HA ' ' A' ' 128' ' ' HIS . 41.2 tt0 -74.95 120.69 20.82 Favored 'General case' 0 C--N 1.286 -2.156 0 CA-C-O 121.362 0.601 . . . . 0.0 111.803 -174.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 126' ' ' LEU . . . . . 0.467 ' HB3' HD13 ' A' ' 4' ' ' LEU . 2.8 mm? -73.25 -39.31 65.54 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.075 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -152.41 130.3 11.73 Favored 'General case' 0 CA--C 1.482 -1.66 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.888 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 128' ' ' HIS . . . . . 0.606 ' HA ' ' CD ' ' A' ' 125' ' ' GLU . 77.8 t60 -65.71 142.37 58.03 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 124.073 0.858 . . . . 0.0 112.242 -174.166 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -45.6 114.57 0.78 Allowed 'General case' 0 C--O 1.239 0.503 0 O-C-N 124.896 1.372 . . . . 0.0 108.784 173.791 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 25.6 m -62.86 133.14 54.24 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.551 -170.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -83.36 158.07 22.3 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.337 -176.318 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.0 p -72.05 108.59 5.35 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-O 121.427 0.632 . . . . 0.0 112.222 -177.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . 0.286 20.6 m120 78.04 -84.33 0.02 OUTLIER 'General case' 0 CA--C 1.493 -1.249 0 C-N-CA 125.291 1.437 . . . . 0.0 114.189 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -129.02 169.26 14.91 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 120.056 -0.658 . . . . 0.0 112.28 -173.385 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 135' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 139' ' ' HIS . 48.9 t -113.23 -38.05 2.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.978 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.624 177.358 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 80.65 -133.77 12.59 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.169 177.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -128.63 16.83 6.42 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 122.51 1.148 . . . . 0.0 109.125 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 168.94 -46.95 0.22 Allowed Glycine 0 CA--C 1.478 -2.222 0 N-CA-C 104.743 -3.343 . . . . 0.0 104.743 -177.281 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' HIS . . . . . 0.439 ' HA ' ' O ' ' A' ' 135' ' ' VAL . 5.2 t60 . . . . . 0 N--CA 1.419 -2.017 0 N-CA-C 103.158 -2.904 . . . . 0.0 103.158 168.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.0 mp . . . . . 0 C--O 1.222 -0.372 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -79.49 143.38 34.96 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -174.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.671 ' SG ' ' HD2' ' A' ' 7' ' ' PRO . 49.0 t -137.37 156.2 75.27 Favored Pre-proline 0 C--N 1.306 -1.293 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.671 ' HD2' ' SG ' ' A' ' 6' ' ' CYS . 81.7 Cg_exo -48.78 153.22 3.79 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 122.843 2.362 . . . . 0.0 112.814 176.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -59.95 -29.37 68.37 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -171.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -78.43 -10.84 59.86 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.295 0.569 . . . . 0.0 111.226 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.476 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 26.9 m95 -95.63 117.03 29.71 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.041 -173.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.421 ' H ' HD22 ' A' ' 11' ' ' LEU . 1.3 mm? -72.72 122.04 20.83 Favored 'General case' 0 CA--C 1.497 -1.066 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -176.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.0 p -92.7 128.52 38.58 Favored 'General case' 0 N--CA 1.41 -2.428 0 CA-C-O 122.355 1.074 . . . . 0.0 113.556 -174.014 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 25.5 t60 -138.41 154.78 48.9 Favored 'General case' 0 C--O 1.2 -1.531 0 C-N-CA 126.973 2.109 . . . . 0.0 105.839 -177.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -11.89 83.98 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.998 0 C-N-CA 125.78 1.632 . . . . 0.0 114.586 175.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.43 ' C ' ' HG3' ' A' ' 16' ' ' LYS . 18.9 m-20 60.74 23.53 13.42 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.801 1.641 . . . . 0.0 114.617 173.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.593 ' HE2' ' OE1' ' A' ' 49' ' ' GLU . 13.0 mtpp -148.86 142.58 25.56 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.859 ' SG ' ' HB3' ' A' ' 124' ' ' LYS . 19.4 p -123.9 139.28 54.11 Favored 'General case' 0 C--N 1.287 -2.116 0 O-C-N 121.511 -0.743 . . . . 0.0 109.807 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.448 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 17.5 m-85 -116.87 140.51 49.37 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -171.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -115.56 106.64 14.16 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.1 t -87.42 92.47 3.81 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.77 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.1 m -77.26 114.56 16.2 Favored 'General case' 0 N--CA 1.423 -1.804 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.354 -176.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.554 ' C ' ' HG2' ' A' ' 119' ' ' ARG . 9.2 mm100 -83.86 13.92 4.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.755 0.822 . . . . 0.0 112.663 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.8 m -109.63 150.09 12.43 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 178.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.0 m -98.24 152.8 19.01 Favored 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -173.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.9 m-20 -154.43 -176.92 6.12 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 127.506 2.322 . . . . 0.0 106.687 178.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 61.3 p -91.81 168.34 11.52 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 168.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 92.0 t90 -58.35 -53.83 53.87 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.593 0.633 . . . . 0.0 112.289 -175.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.492 ' O ' HG23 ' A' ' 32' ' ' VAL . 42.9 mt-10 -64.93 -31.93 73.41 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.307 0.575 . . . . 0.0 110.416 -177.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -71.45 -42.15 68.56 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.124 -0.943 . . . . 0.0 110.594 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.57 -33.88 87.51 Favored Glycine 0 CA--C 1.501 -0.843 0 N-CA-C 110.859 -0.896 . . . . 0.0 110.859 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 tt -59.91 -46.86 88.01 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 176.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 28' ' ' GLU . 90.1 t -61.87 -36.68 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.274 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -61.26 -36.76 80.9 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.845 175.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.0 m -71.51 -40.07 70.38 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -55.98 -39.7 72.2 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -56.17 -34.41 62.54 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 114.943 -1.026 . . . . 0.0 114.434 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -89.76 -5.3 57.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.51 0.655 . . . . 0.0 111.507 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.06 51.91 5.98 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 107.753 -2.139 . . . . 0.0 107.753 -171.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.01 178.04 8.5 Favored 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.2 p -123.14 158.48 30.62 Favored 'General case' 0 C--N 1.281 -2.409 0 C-N-CA 122.765 0.426 . . . . 0.0 110.936 -177.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.1 tp -76.15 130.48 38.33 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 174.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.2 tpt -30.03 120.53 0.17 Allowed 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 117.264 2.32 . . . . 0.0 117.264 -169.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.444 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 3.1 mm? -109.1 110.95 22.32 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 124.704 1.201 . . . . 0.0 108.007 177.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.515 HD13 HD21 ' A' ' 50' ' ' LEU . 37.8 mt -98.68 132.84 43.1 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -175.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.488 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 56.0 tp60 -105.84 -44.27 4.67 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 120.868 0.365 . . . . 0.0 111.464 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -137.57 178.13 7.34 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -172.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -81.04 -19.42 43.88 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 122.049 -0.407 . . . . 0.0 110.362 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 51.9 mt-10 -57.91 -33.23 68.54 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.699 0.762 . . . . 0.0 109.788 173.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.593 ' OE1' ' HE2' ' A' ' 16' ' ' LYS . 10.2 mm-40 -64.89 -55.36 19.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.671 -1.15 . . . . 0.0 107.995 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.515 HD21 HD13 ' A' ' 44' ' ' ILE . 63.4 mt -68.96 -25.15 64.4 Favored 'General case' 0 CA--C 1.496 -1.13 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -176.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.509 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 34.7 ptt180 -68.93 -33.73 74.21 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.363 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -73.72 -28.21 61.59 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.669 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.4 mm? -63.75 -48.83 75.4 Favored 'General case' 0 C--O 1.176 -2.805 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 43.7 mt -54.76 -34.11 62.15 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -67.35 -46.74 72.51 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.953 0.406 . . . . 0.0 111.444 172.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.8 p -81.17 -20.88 40.27 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -174.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.669 HG12 ' O ' ' A' ' 53' ' ' LEU . 16.6 mm -56.24 -45.97 81.27 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 C-N-CA 123.817 0.847 . . . . 0.0 111.031 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? 69.86 -63.69 0.38 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.024 0.929 . . . . 0.0 112.798 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.87 -56.34 6.5 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -175.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.418 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 91.4 mttt 74.06 -38.57 0.4 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.175 0.99 . . . . 0.0 113.669 -176.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -82.3 28.85 0.44 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.879 0.847 . . . . 0.0 111.707 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.44 ' ND2' HE22 ' A' ' 22' ' ' GLN . 53.4 m-80 -132.6 -173.99 3.33 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.026 177.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.607 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 13.3 m -137.63 133.09 33.93 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.483 ' CE2' HD12 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -131.47 118.62 20.44 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -175.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -59.99 135.95 57.87 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 123.357 0.663 . . . . 0.0 112.038 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.59 176.21 2.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 N-CA-C 106.6 -1.629 . . . . 0.0 106.6 169.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.558 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.28 40.44 1.73 Allowed Glycine 0 C--O 1.22 -0.763 0 CA-C-N 118.89 0.768 . . . . 0.0 114.59 -174.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.558 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 20.5 mt -101.93 115.51 30.7 Favored 'General case' 0 CA--C 1.488 -1.422 0 C-N-CA 123.191 0.596 . . . . 0.0 111.637 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 28.4 ptt180 -122.02 137.22 54.88 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.104 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -91.11 113.69 26.02 Favored 'General case' 0 C--N 1.287 -2.137 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 22.7 p . . . . . 0 C--N 1.301 -1.514 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -174.129 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 16.3 m120 . . . . . 0 CA--C 1.492 -1.278 0 CA-C-O 121.047 0.451 . . . . 0.0 110.052 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -88.92 125.72 35.07 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.371 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -118.9 158.84 24.91 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.121 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.558 ' CZ3' ' HG ' ' A' ' 68' ' ' LEU . 62.4 m95 -96.19 176.32 6.12 Favored 'General case' 0 C--N 1.277 -2.572 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.4 pt -73.36 -23.34 19.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 CA-C-O 121.01 0.433 . . . . 0.0 111.362 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.416 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 29.6 p-10 -83.3 -16.32 46.68 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.3 8.49 35.64 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.435 -0.802 . . . . 0.0 113.081 175.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.8 m -75.65 170.52 16.01 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 175.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 20.7 m -102.54 139.68 37.82 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.533 HD13 HD21 ' A' ' 68' ' ' LEU . 42.0 tp -62.98 142.36 58.39 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 176.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -95.7 86.8 4.5 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.6 p -71.09 -8.23 52.02 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -176.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -77.94 -14.12 59.64 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 27.7 m -75.76 -49.66 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.828 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.0 mt -147.69 -179.01 6.57 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 -173.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 99.87 1.74 Allowed 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.48 HD12 HD11 ' A' ' 85' ' ' LEU . 8.0 mt -140.51 96.67 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 172.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.3 m -62.24 124.67 21.48 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.884 -178.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -85.69 -41.49 7.24 Favored Glycine 0 N--CA 1.41 -3.059 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -94.29 88.37 5.54 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-O 121.82 0.819 . . . . 0.0 110.971 178.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.8 t -126.39 -32.43 2.68 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.536 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 60.83 36.99 18.91 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.303 0.641 . . . . 0.0 111.383 176.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -116.99 177.82 4.57 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -81.58 27.69 0.43 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 126.167 1.787 . . . . 0.0 109.372 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.411 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 13.9 m -72.85 142.62 47.97 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -170.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 61.6 m -133.06 146.28 51.54 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 103.944 -2.613 . . . . 0.0 103.944 166.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -99.81 153.14 19.37 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -172.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.29 148.43 36.33 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.61 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.607 ' O ' ' HA ' ' A' ' 63' ' ' SER . 11.0 mm -78.13 128.4 38.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.483 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 175.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.1 t -140.42 90.17 2.34 Favored 'General case' 0 N--CA 1.408 -2.529 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.418 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . 89.0 -126.65 8.3 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.25 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -101.86 8.55 41.23 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 176.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -119.13 167.21 12.02 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.814 -175.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 14.2 t -115.75 134.24 59.63 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 N-CA-C 104.682 -2.34 . . . . 0.0 104.682 173.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 69.7 p -124.97 170.07 11.48 Favored 'General case' 0 C--N 1.267 -2.988 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.411 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 25.4 p90 -148.46 142.04 25.45 Favored 'General case' 0 C--N 1.298 -1.666 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.421 -178.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -154.69 178.69 9.83 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.815 -176.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.424 ' HB3' ' ND2' ' A' ' 115' ' ' ASN . 29.3 m -54.07 124.53 15.9 Favored 'General case' 0 N--CA 1.443 -0.817 0 O-C-N 124.132 0.895 . . . . 0.0 108.992 176.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 8.4 m -53.57 -22.88 9.27 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.491 1.117 . . . . 0.0 112.635 -174.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.424 ' ND2' ' HB3' ' A' ' 113' ' ' SER . 9.1 p30 -80.43 -2.06 44.15 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 24.9 p -74.47 136.58 42.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 119.236 0.925 . . . . 0.0 112.608 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.79 101.42 0.26 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.328 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' ASN . . . . . 0.531 ' OD1' ' HB2' ' A' ' 63' ' ' SER . 47.3 m-80 -142.58 158.98 43.1 Favored 'General case' 0 CA--C 1.485 -1.539 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.209 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.77 ' HB3' ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.57 178.68 6.49 Favored 'General case' 0 C--N 1.292 -1.925 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.093 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 18.4 p90 -152.36 167.14 29.65 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 118.733 -1.187 . . . . 0.0 112.36 -174.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.507 HD13 HD12 ' A' ' 53' ' ' LEU . 82.6 mt -125.29 118.28 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 CA-C-O 121.625 0.726 . . . . 0.0 110.712 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 90.7 m -97.02 140.87 30.89 Favored 'General case' 0 C--N 1.287 -2.135 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.758 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 123' ' ' GLN . 5.0 pt20 -120.12 137.86 53.91 Favored 'General case' 0 N--CA 1.415 -2.213 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 173.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.859 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 22.8 ttmm -110.95 110.91 21.69 Favored 'General case' 0 C--N 1.258 -3.374 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 171.113 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -83.54 124.0 30.31 Favored 'General case' 0 N--CA 1.406 -2.63 0 C-N-CA 119.621 -0.832 . . . . 0.0 108.767 -175.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . . . . . . . . . 1.8 mm? . . . . . 0 C--N 1.316 -0.852 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.255 -177.117 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.442 HD13 ' HB3' ' A' ' 126' ' ' LEU . 4.7 mp . . . . . 0 N--CA 1.44 -0.936 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -94.38 135.05 36.24 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.577 -176.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.494 ' HB3' HD11 ' A' ' 126' ' ' LEU . 8.8 p -128.58 166.41 24.76 Favored Pre-proline 0 C--N 1.296 -1.738 0 C-N-CA 124.089 0.956 . . . . 0.0 108.501 177.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -61.42 156.91 43.66 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 121.641 1.561 . . . . 0.0 113.155 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -42.64 -48.64 5.51 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 116.299 1.963 . . . . 0.0 116.299 -175.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -83.76 7.15 18.68 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -172.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.521 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 60.1 m95 -104.4 121.45 43.42 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 121.232 0.539 . . . . 0.0 110.711 -177.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.534 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 4.8 mp -75.92 106.51 7.54 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 124.843 1.257 . . . . 0.0 111.063 -176.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.1 p -74.66 114.44 13.08 Favored 'General case' 0 C--N 1.276 -2.625 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.794 -176.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -138.93 125.72 20.9 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 123.999 0.919 . . . . 0.0 109.413 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 72.3 mtt180 57.93 -88.61 0.02 OUTLIER 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -178.623 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.0 p-10 -144.69 25.31 1.48 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.499 0.666 . . . . 0.0 110.112 -177.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.36 151.7 36.96 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 178.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.636 ' SG ' HD21 ' A' ' 126' ' ' LEU . 80.8 m -116.34 140.36 49.42 Favored 'General case' 0 C--N 1.275 -2.631 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.057 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -110.82 141.67 43.86 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -119.24 108.17 14.31 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 173.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.0 t -89.18 95.05 5.13 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.69 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.8 m -77.97 115.19 17.52 Favored 'General case' 0 N--CA 1.417 -2.085 0 CA-C-N 115.328 -0.851 . . . . 0.0 108.725 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.576 HE22 ' ND2' ' A' ' 62' ' ' ASN . 12.0 mm100 -87.82 13.75 10.08 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.956 0.902 . . . . 0.0 111.255 -178.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.8 m -107.65 156.48 8.12 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 37.7 m -91.77 156.74 17.33 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -173.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.1 m-20 -170.88 170.75 6.28 Favored 'General case' 0 CA--C 1.502 -0.876 0 C-N-CA 127.414 2.286 . . . . 0.0 107.912 175.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.5 p -85.02 166.02 17.06 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 172.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.534 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 88.9 t90 -56.48 -53.26 59.54 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -174.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.461 ' O ' HG23 ' A' ' 32' ' ' VAL . 37.9 mt-10 -63.92 -32.29 73.77 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.942 0.877 . . . . 0.0 110.556 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -73.91 -44.28 55.68 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.46 -1.245 . . . . 0.0 110.412 -175.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.12 -34.63 90.49 Favored Glycine 0 C--O 1.221 -0.682 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 174.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 tt -58.86 -51.17 71.14 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 28' ' ' GLU . 87.6 t -59.3 -38.21 73.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.502 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.89 -36.64 84.59 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.98 -0.555 . . . . 0.0 112.103 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 81.3 m -66.34 -43.47 86.02 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -57.23 -29.88 64.13 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.577 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -56.92 -34.91 66.33 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.933 179.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -101.44 11.57 38.89 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.78 14.07 82.93 Favored Glycine 0 C--O 1.245 0.794 0 CA-C-O 121.625 0.57 . . . . 0.0 111.763 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -104.69 166.16 10.58 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -175.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.429 ' HB ' HD11 ' A' ' 80' ' ' ILE . 3.2 p -110.01 160.57 16.32 Favored 'General case' 0 C--N 1.28 -2.441 0 O-C-N 122.175 -0.328 . . . . 0.0 110.626 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -75.52 124.69 27.61 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.3 tpt -24.72 120.09 0.05 Allowed 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 -170.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -110.55 105.45 14.39 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 124.845 1.258 . . . . 0.0 107.62 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.517 HD13 HD11 ' A' ' 50' ' ' LEU . 34.2 mt -86.22 105.81 15.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -176.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -90.27 -22.69 21.47 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.731 -176.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.545 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 15.9 t70 -149.64 163.9 36.63 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -170.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -35.22 80.32 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 176.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -60.56 -27.83 67.97 Favored 'General case' 0 CA--C 1.499 -0.983 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.545 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 13.3 mm-40 -57.54 -55.79 30.26 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.652 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 61.6 mt -71.88 -25.78 62.07 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -177.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -62.88 -38.01 89.2 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -68.06 -37.0 80.79 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.692 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.5 mm? -62.48 -53.17 58.81 Favored 'General case' 0 C--O 1.206 -1.193 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.652 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 60.3 mt -56.49 -34.59 67.1 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -177.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -73.56 -41.91 62.32 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 176.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.3 p -81.4 -34.98 31.26 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.692 HG12 ' O ' ' A' ' 53' ' ' LEU . 51.0 mm -57.12 -45.73 84.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 CA-C-O 121.244 0.545 . . . . 0.0 109.655 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 52.0 tptt 68.96 -56.79 0.53 Allowed 'General case' 0 C--O 1.24 0.588 0 C-N-CA 124.895 1.278 . . . . 0.0 112.858 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -62.26 -52.18 64.75 Favored 'General case' 0 C--O 1.207 -1.156 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.61 ' H ' HG22 ' A' ' 57' ' ' ILE . 97.6 mttt 73.86 -47.98 0.66 Allowed 'General case' 0 C--O 1.205 -1.27 0 C-N-CA 124.98 1.312 . . . . 0.0 112.712 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -70.21 27.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.168 1.387 . . . . 0.0 114.058 -174.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.576 ' ND2' HE22 ' A' ' 22' ' ' GLN . 77.6 m-20 -115.29 -171.18 1.91 Allowed 'General case' 0 C--N 1.286 -2.186 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 176.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.657 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 14.0 m -144.82 119.3 9.67 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.532 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.5 m-85 -124.33 123.47 40.27 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -176.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.533 ' CE2' ' HB2' ' A' ' 118' ' ' ASN . 78.0 m95 -62.17 138.86 58.47 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 123.182 0.593 . . . . 0.0 110.616 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -118.45 174.67 4.11 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 169.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.619 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.41 47.52 2.39 Favored Glycine 0 C--O 1.21 -1.386 0 CA-C-N 118.728 0.695 . . . . 0.0 114.817 -173.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.494 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 17.3 mt -113.4 120.01 39.61 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 123.451 0.701 . . . . 0.0 111.901 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -126.4 140.38 52.53 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.291 176.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -91.06 124.5 35.34 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 35.5 p . . . . . 0 C--N 1.3 -1.572 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -175.397 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.9 m120 . . . . . 0 C--O 1.258 1.509 0 CA-C-O 121.097 0.475 . . . . 0.0 110.114 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 66.8 m95 -97.41 134.41 40.71 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -126.79 151.97 47.55 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.683 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.619 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 37.0 m95 -93.63 169.93 9.96 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.429 HD11 ' HB ' ' A' ' 40' ' ' THR . 38.6 pt -69.38 -20.42 24.13 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -177.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.4 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 31.3 p-10 -85.05 -14.14 48.24 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.655 0.741 . . . . 0.0 109.286 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.98 8.41 36.55 Favored Glycine 0 N--CA 1.443 -0.894 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.363 176.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.8 m -74.97 163.42 27.64 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.032 0.444 . . . . 0.0 111.692 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 19.9 m -98.96 140.4 33.16 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 176.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.574 HD11 HD12 ' A' ' 92' ' ' ILE . 43.5 tp -54.64 143.86 23.57 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -100.87 95.73 6.82 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 170.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.0 m -71.39 -11.28 60.81 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.123 0.487 . . . . 0.0 111.814 -175.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -78.14 -12.49 60.0 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -176.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 29.2 m -75.3 -54.2 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 C-N-CA 119.079 -1.048 . . . . 0.0 112.473 -177.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.5 mt -152.03 -178.29 6.68 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -177.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -68.33 111.88 4.87 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -176.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.574 HD12 HD11 ' A' ' 85' ' ' LEU . 9.7 mt -145.97 105.44 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 174.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.0 m -61.06 128.99 39.16 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 123.021 0.529 . . . . 0.0 109.899 -179.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -84.33 -53.33 3.3 Favored Glycine 0 N--CA 1.418 -2.516 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 -176.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -93.23 82.56 4.53 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-O 122.767 1.27 . . . . 0.0 110.536 176.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.6 t -100.69 -24.01 14.51 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.587 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 63.46 17.63 10.47 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.609 0.764 . . . . 0.0 112.218 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -111.32 -178.68 3.51 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -86.67 26.93 1.03 Allowed 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 126.654 1.982 . . . . 0.0 109.798 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 m -72.1 150.72 43.63 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 116.619 2.081 . . . . 0.0 116.619 -170.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -143.45 148.78 36.63 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 166.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -98.09 153.81 18.17 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -169.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.25 150.2 38.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.376 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.657 ' O ' ' HA ' ' A' ' 63' ' ' SER . 17.5 mm -77.82 112.11 15.41 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.532 0 N-CA-C 106.627 -1.619 . . . . 0.0 106.627 173.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.564 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 8.8 t -134.04 100.6 4.77 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 98.62 -134.43 11.69 Favored Glycine 0 C--N 1.276 -2.79 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -100.15 0.98 41.63 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -128.77 -176.66 3.91 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.315 -172.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.2 t -105.88 135.41 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.548 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 71.2 p -131.32 175.08 9.43 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 106.406 -1.701 . . . . 0.0 106.406 176.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -146.5 156.91 43.61 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 119.94 1.245 . . . . 0.0 113.307 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -161.3 -176.38 5.37 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.362 1.065 . . . . 0.0 109.67 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 17.5 t -68.66 128.38 36.42 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 176.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.534 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 79.5 m -50.62 -12.93 0.11 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 126.045 1.738 . . . . 0.0 115.202 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -100.97 3.66 41.81 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.279 -168.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.5 p -85.81 172.65 10.62 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 121.593 0.711 . . . . 0.0 111.522 177.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.54 123.07 26.68 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.227 175.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' ASN . . . . . 0.533 ' HB2' ' CE2' ' A' ' 65' ' ' TRP . 74.5 m-20 -158.88 172.73 17.68 Favored 'General case' 0 CA--C 1.488 -1.439 0 C-N-CA 125.092 1.357 . . . . 0.0 107.421 172.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.69 ' HB3' ' O ' ' A' ' 21' ' ' SER . 2.2 mpt_? -100.96 -169.92 1.77 Allowed 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 178.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 16.0 p90 -154.41 160.99 41.95 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.663 1.574 . . . . 0.0 112.573 -177.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 75.3 mt -120.83 125.54 74.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.941 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 72.2 m -106.17 146.9 29.66 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.109 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -123.77 133.91 53.75 Favored 'General case' 0 N--CA 1.425 -1.718 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 173.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.7 tttm -109.81 109.21 19.8 Favored 'General case' 0 C--N 1.272 -2.763 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.35 124.23 28.68 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 121.353 0.597 . . . . 0.0 110.69 -172.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.636 HD21 ' SG ' ' A' ' 17' ' ' CYS . 2.9 mm? . . . . . 0 C--N 1.312 -1.05 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.091 -178.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.65 HD13 ' HB3' ' A' ' 126' ' ' LEU . 4.8 mp . . . . . 0 CA--C 1.545 0.764 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -87.37 147.44 25.47 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -177.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.556 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 65.0 m -113.45 164.36 15.97 Favored Pre-proline 0 C--N 1.301 -1.508 0 CA-C-N 113.759 -1.564 . . . . 0.0 110.591 -177.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.29 164.06 18.59 Favored 'Trans proline' 0 C--N 1.367 1.501 0 C-N-CA 122.2 1.934 . . . . 0.0 112.377 175.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -53.98 -35.66 62.06 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -174.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.55 4.76 50.31 Favored 'General case' 0 C--N 1.317 -0.809 0 O-C-N 121.986 -0.446 . . . . 0.0 111.418 -175.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 24.9 m95 -112.89 145.93 39.85 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 120.821 0.343 . . . . 0.0 110.973 -174.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.1 mm? -100.62 178.83 4.6 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 105.271 -2.122 . . . . 0.0 105.271 173.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.556 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 56.1 p -155.89 148.81 24.25 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 119.525 1.057 . . . . 0.0 113.334 179.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 29.2 t-80 -154.37 135.96 14.32 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 67.83 -70.87 0.11 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.625 1.17 . . . . 0.0 113.828 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . 0.454 ' C ' ' HD3' ' A' ' 16' ' ' LYS . 9.4 p-10 -167.31 24.69 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.839 -174.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.454 ' HD3' ' C ' ' A' ' 15' ' ' ASP . 3.9 mppt? -144.5 143.8 31.03 Favored 'General case' 0 CA--C 1.511 -0.547 0 C-N-CA 122.834 0.454 . . . . 0.0 110.358 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.563 ' O ' ' HA ' ' A' ' 123' ' ' GLN . 15.2 m -97.1 151.36 19.84 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 174.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -130.77 134.04 46.52 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 118.486 0.585 . . . . 0.0 110.046 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -119.76 108.94 15.02 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.6 t -83.87 93.79 3.29 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.778 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.5 m -77.67 110.8 12.81 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.243 -177.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -83.44 14.35 3.75 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.889 0.876 . . . . 0.0 112.962 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.59 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 6.7 m -107.14 153.55 8.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.7 m -108.83 143.96 37.32 Favored 'General case' 0 C--N 1.3 -1.543 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -173.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -154.3 172.98 16.8 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 126.476 1.91 . . . . 0.0 108.994 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.4 p -77.86 166.68 22.61 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 171.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 t90 -56.56 -50.96 70.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.337 0.589 . . . . 0.0 111.477 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.532 ' H ' ' CD ' ' A' ' 28' ' ' GLU . 0.1 OUTLIER -65.92 -35.95 82.04 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.993 -176.615 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -66.3 -45.06 81.69 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.832 -179.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.65 -32.24 82.76 Favored Glycine 0 N--CA 1.465 0.594 0 C-N-CA 121.39 -0.434 . . . . 0.0 112.388 176.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tt -61.28 -51.52 68.56 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 58.8 t -61.92 -32.08 53.1 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.331 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.547 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 0.9 OUTLIER -61.65 -45.3 94.64 Favored 'General case' 0 CA--C 1.501 -0.935 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.853 174.835 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 60.5 m -64.25 -41.92 96.74 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -56.69 -38.05 71.74 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 123.793 0.683 . . . . 0.0 109.637 176.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.26 -23.15 61.8 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 114.913 -1.039 . . . . 0.0 114.036 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.547 ' HD2' ' O ' ' A' ' 33' ' ' ASP . 2.1 mptp? -97.27 2.73 51.14 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 117.915 0.857 . . . . 0.0 110.711 177.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.93 50.01 25.68 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 108.499 -1.84 . . . . 0.0 108.499 -173.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.572 ' HB1' ' O ' ' A' ' 123' ' ' GLN . . . -147.82 176.77 9.87 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.402 ' HB ' HD11 ' A' ' 80' ' ' ILE . 1.6 p -116.14 164.86 13.86 Favored 'General case' 0 C--N 1.292 -1.917 0 C-N-CA 122.798 0.439 . . . . 0.0 110.684 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.0 tp -80.96 127.95 33.14 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 105.936 -1.876 . . . . 0.0 105.936 174.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.3 tpt -28.73 122.4 0.12 Allowed 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 -169.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -114.68 108.86 17.36 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.345 1.458 . . . . 0.0 107.387 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.499 HD13 HD11 ' A' ' 50' ' ' LEU . 52.9 mt -88.88 110.57 21.54 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.152 0.501 . . . . 0.0 111.512 -173.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -79.97 -32.32 39.85 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.794 -177.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -158.59 169.33 24.66 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -34.34 76.54 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 123.496 0.718 . . . . 0.0 109.62 178.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 12.0 pt-20 -58.38 -27.31 64.12 Favored 'General case' 0 C--O 1.243 0.723 0 C-N-CA 122.886 0.474 . . . . 0.0 111.363 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -66.92 -54.35 22.95 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 37.7 mt -66.65 -26.95 67.3 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.499 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 20.3 ptt180 -68.58 -32.02 71.64 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 119.331 -0.948 . . . . 0.0 109.363 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -74.26 -27.99 61.0 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.693 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -65.17 -48.15 74.48 Favored 'General case' 0 C--O 1.193 -1.906 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 46.3 mt -57.78 -33.43 68.52 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 123.412 0.445 . . . . 0.0 111.464 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.92 -41.76 97.57 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.551 175.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.3 p -88.27 -24.64 23.15 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -176.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.693 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.8 mm -56.33 -47.77 80.76 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 C-N-CA 123.603 0.761 . . . . 0.0 111.081 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 52.5 tptt 67.98 -69.65 0.14 Allowed 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.916 1.286 . . . . 0.0 113.696 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -65.55 -34.56 78.53 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.585 ' H ' HG22 ' A' ' 57' ' ' ILE . 49.4 mttp 72.98 -57.19 0.64 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.755 1.222 . . . . 0.0 112.354 177.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -68.74 6.55 0.83 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.168 1.387 . . . . 0.0 114.407 -170.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.593 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 51.2 m-80 -82.63 -168.49 2.04 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 173.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 8.3 m -140.22 114.51 9.19 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.593 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 4.9 m-85 -121.55 120.11 33.9 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.267 -177.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.42 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 55.0 m95 -62.81 137.59 58.31 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 123.067 0.547 . . . . 0.0 111.071 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.88 177.33 2.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 167.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.693 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.28 54.07 3.55 Favored Glycine 0 C--O 1.199 -2.07 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.382 -176.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 35.1 mt -126.52 118.28 24.58 Favored 'General case' 0 CA--C 1.489 -1.383 0 C-N-CA 123.55 0.74 . . . . 0.0 111.689 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -133.73 141.49 47.55 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 173.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.449 ' HE1' ' O ' ' A' ' 94' ' ' GLY . 59.1 t80 -86.14 112.59 21.45 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 104.26 -2.496 . . . . 0.0 104.26 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.274 -2.681 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -173.574 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 8.8 m120 . . . . . 0 CA--C 1.507 -0.689 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -95.27 111.46 23.31 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -114.38 147.65 38.86 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.102 -178.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.693 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 49.0 m95 -93.4 169.21 10.54 Favored 'General case' 0 N--CA 1.429 -1.522 0 CA-C-N 114.772 -1.103 . . . . 0.0 108.55 178.282 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.402 HD11 ' HB ' ' A' ' 40' ' ' THR . 40.8 pt -71.83 -13.9 17.11 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.909 -178.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.541 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 33.7 p-10 -89.84 -11.0 43.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.485 0.659 . . . . 0.0 109.402 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.12 1.05 44.84 Favored Glycine 0 CA--C 1.499 -0.918 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.155 174.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 57.2 m -80.04 165.77 22.21 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 122.834 0.454 . . . . 0.0 111.939 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.3 m -105.05 141.87 35.85 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.447 HD11 HD12 ' A' ' 92' ' ' ILE . 39.0 tp -56.91 140.21 49.21 Favored 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 124.98 1.312 . . . . 0.0 113.845 178.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -95.2 98.39 10.59 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 166.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.4 p -70.61 -8.68 53.48 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -175.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -78.44 -6.0 54.06 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 27.5 m -74.73 -48.22 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 C-N-CA 119.045 -1.062 . . . . 0.0 111.266 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.1 mt -153.78 177.56 10.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -177.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.89 109.51 2.11 Favored 'General case' 0 CA--C 1.499 -1.001 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.447 HD12 HD11 ' A' ' 85' ' ' LEU . 9.4 mt -146.66 106.3 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 171.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.7 m -63.97 122.26 16.07 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.449 ' O ' ' HE1' ' A' ' 70' ' ' TYR . . . -89.54 -19.53 48.43 Favored Glycine 0 N--CA 1.419 -2.445 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -174.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -122.3 104.84 9.7 Favored 'General case' 0 N--CA 1.422 -1.825 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 175.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.489 HG23 ' H ' ' A' ' 98' ' ' ASN . 12.3 t -141.36 -26.05 0.7 Allowed 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.4 -173.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 62.67 29.41 16.85 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.489 ' H ' HG23 ' A' ' 96' ' ' THR . 40.6 m-80 -122.53 143.84 49.47 Favored 'General case' 0 C--O 1.205 -1.282 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 175.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -82.55 27.32 0.52 Allowed 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 125.049 1.34 . . . . 0.0 110.622 -172.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 32.8 t -74.09 158.29 34.51 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 125.782 1.633 . . . . 0.0 112.276 -173.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 88.5 m -117.31 143.88 45.46 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -89.45 143.12 27.07 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-O 121.427 0.632 . . . . 0.0 112.154 -175.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -141.07 151.74 44.26 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.556 -178.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.439 HD11 HD22 ' A' ' 50' ' ' LEU . 13.9 mm -77.48 121.77 30.74 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 175.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 8.8 t -145.32 97.31 2.98 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.71 -119.83 6.66 Favored Glycine 0 C--N 1.283 -2.374 0 CA-C-N 114.317 -1.31 . . . . 0.0 110.186 179.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.506 ' OD2' ' HE2' ' A' ' 108' ' ' LYS . 6.5 p-10 -115.19 8.52 15.59 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 123.323 0.649 . . . . 0.0 109.249 177.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.506 ' HE2' ' OD2' ' A' ' 107' ' ' ASP . 74.4 mmtt -134.92 174.69 10.32 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.486 -176.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.3 t -101.39 130.65 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.031 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 175.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 59.1 p -131.6 141.83 49.75 Favored 'General case' 0 C--N 1.272 -2.788 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.437 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 6.8 p90 -99.79 133.1 44.64 Favored 'General case' 0 C--N 1.287 -2.115 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -177.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -121.1 165.75 14.89 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 114.427 -1.261 . . . . 0.0 107.622 -174.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 38.2 m -64.74 130.59 44.11 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 8.5 m -59.98 -19.64 53.35 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.417 0.627 . . . . 0.0 111.434 -175.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -93.38 4.39 54.04 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.255 1.022 . . . . 0.0 112.574 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.4 p -73.54 -7.95 53.96 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 13.8 t70 62.64 87.48 0.1 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.628 1.171 . . . . 0.0 110.392 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -127.81 175.07 8.61 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -177.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.778 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.2 mpt_? -83.43 -174.7 5.44 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 -177.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.447 ' CH2' HG23 ' A' ' 23' ' ' VAL . 26.9 p90 -156.58 172.72 18.08 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.659 1.118 . . . . 0.0 112.132 -177.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 85.5 mt -126.44 122.59 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-O 121.417 0.627 . . . . 0.0 110.128 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 74.3 m -100.12 143.72 29.99 Favored 'General case' 0 C--N 1.29 -2.022 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.572 ' O ' ' HB1' ' A' ' 39' ' ' ALA . 6.3 pt20 -121.54 154.06 37.18 Favored 'General case' 0 N--CA 1.417 -2.089 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 173.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.404 ' HB3' ' HB2' ' A' ' 17' ' ' CYS . 21.6 ttmm -132.33 110.47 10.6 Favored 'General case' 0 C--N 1.268 -2.95 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 176.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -75.9 118.33 18.58 Favored 'General case' 0 C--N 1.282 -2.338 0 CA-C-O 121.648 0.737 . . . . 0.0 111.96 -177.304 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.65 ' HB3' HD13 ' A' ' 4' ' ' LEU . 2.6 mm? . . . . . 0 N--CA 1.435 -1.201 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.414 176.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.434 HD13 ' HG ' ' A' ' 126' ' ' LEU . 2.2 mp . . . . . 0 CA--C 1.547 0.847 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -99.21 140.14 33.82 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.168 -1.013 . . . . 0.0 111.8 178.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 65.7 m -101.93 161.91 22.0 Favored Pre-proline 0 C--N 1.309 -1.179 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.665 -176.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.602 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 31.8 Cg_exo -61.81 156.37 48.93 Favored 'Trans proline' 0 CA--C 1.555 1.562 0 C-N-CA 121.612 1.541 . . . . 0.0 109.854 173.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -51.71 -33.66 35.34 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 116.528 2.048 . . . . 0.0 116.528 -169.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -97.71 5.77 48.83 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 121.714 -0.616 . . . . 0.0 111.887 -174.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.602 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 17.3 m95 -101.14 135.95 41.78 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 120.647 0.261 . . . . 0.0 111.302 -174.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.409 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.5 mm? -93.83 130.4 39.88 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.547 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 25.8 p -96.43 130.25 43.61 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -175.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -151.09 119.44 6.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.954 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.407 ' HD3' ' OE1' ' A' ' 48' ' ' GLU . 21.8 mtm180 54.68 46.36 24.85 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 125.849 1.659 . . . . 0.0 112.796 175.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 14.5 m-20 69.73 36.27 2.15 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.136 0.974 . . . . 0.0 111.026 179.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' A' ' 12' ' ' SER . 10.2 mptt -141.72 159.83 41.42 Favored 'General case' 0 CA--C 1.499 -1.001 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 174.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.709 ' SG ' HD13 ' A' ' 126' ' ' LEU . 4.6 m -129.44 132.26 46.93 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 177.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 19.3 m-85 -111.41 137.28 49.4 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 117.911 0.323 . . . . 0.0 110.832 -177.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.452 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 42.3 t-80 -121.11 108.33 13.67 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.7 t -88.22 93.59 4.31 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 176.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.73 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 4.1 m -77.76 113.56 15.75 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.053 -177.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.473 ' C ' ' HG2' ' A' ' 119' ' ' ARG . 13.4 mm100 -85.0 14.36 5.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.803 0.841 . . . . 0.0 111.962 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 13.9 m -105.68 157.21 6.38 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 179.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 m -110.4 147.29 34.3 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -169.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.446 ' HB3' ' HB3' ' A' ' 29' ' ' GLU . 35.2 m-20 -159.73 -178.07 6.81 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 126.491 1.916 . . . . 0.0 108.7 -178.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 71.2 p -86.5 170.38 11.98 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 171.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 87.9 t90 -59.91 -51.58 69.09 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.016 0.436 . . . . 0.0 110.43 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.483 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 49.9 mt-10 -67.47 -31.23 71.24 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.726 -177.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . 0.446 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 7.8 tp10 -67.21 -49.55 64.13 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.88 -31.92 80.1 Favored Glycine 0 C--N 1.344 0.975 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.782 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.483 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 3.1 tm? -55.2 -51.29 67.03 Favored 'General case' 0 C--O 1.251 1.158 0 C-N-CA 124.17 0.988 . . . . 0.0 109.04 176.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 57.5 t -67.06 -35.09 73.64 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.468 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.43 -36.55 76.1 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 176.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 61.8 m -70.61 -41.86 71.72 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.417 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -61.74 -25.66 67.58 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.88 -37.16 93.89 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.761 -0.654 . . . . 0.0 113.199 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -86.46 2.73 46.77 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.858 -0.201 . . . . 0.0 110.779 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.52 41.38 30.02 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 108.665 -1.774 . . . . 0.0 108.665 -174.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -132.83 177.07 7.92 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.783 -0.708 . . . . 0.0 109.227 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.486 ' HB ' HD11 ' A' ' 80' ' ' ILE . 2.7 p -120.9 154.04 36.41 Favored 'General case' 0 C--N 1.279 -2.479 0 O-C-N 123.634 0.584 . . . . 0.0 109.498 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.6 tp -66.05 139.81 58.22 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 172.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.9 tpt -35.82 118.75 0.52 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 114.681 1.364 . . . . 0.0 114.681 -170.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.0 tp -120.51 106.35 11.72 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 -174.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.521 HD13 HD11 ' A' ' 50' ' ' LEU . 30.7 mt -98.05 112.96 31.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 CA-C-O 121.25 0.548 . . . . 0.0 111.949 -169.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -90.16 -31.22 17.16 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.67 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -143.65 161.54 38.27 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -173.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.505 ' NE2' ' HA ' ' A' ' 89' ' ' VAL . 6.9 tt0 -74.32 -25.36 59.51 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 122.536 0.334 . . . . 0.0 110.565 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.657 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 7.7 pt-20 -69.08 -26.13 64.79 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.935 176.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -57.27 -54.1 50.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 173.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.521 HD11 HD13 ' A' ' 44' ' ' ILE . 62.4 mt -67.69 -26.8 66.36 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.657 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 4.1 ppt_? -66.45 -36.6 83.18 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -73.44 -25.74 60.64 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.674 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -63.53 -48.82 75.96 Favored 'General case' 0 CA--C 1.477 -1.848 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 172.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 37.7 mt -55.12 -38.8 68.65 Favored 'General case' 0 C--O 1.244 0.784 0 O-C-N 123.756 0.66 . . . . 0.0 110.717 177.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -59.16 -43.19 92.1 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.73 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.8 p -81.26 -27.01 35.34 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 53' ' ' LEU . 32.7 mm -67.1 -58.21 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.562 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -178.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? 67.36 -59.07 0.41 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.84 0.856 . . . . 0.0 112.921 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -61.04 -60.36 3.9 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 123.079 0.552 . . . . 0.0 112.418 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt 71.16 15.51 6.47 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.9 0.88 . . . . 0.0 113.044 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 67.0 m-85 -125.59 30.84 5.66 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.631 0.729 . . . . 0.0 111.62 -179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 105' ' ' SER . 65.2 m-80 -127.11 -159.66 0.95 Allowed 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 175.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 54.7 m -151.97 126.68 9.54 Favored 'General case' 0 C--O 1.25 1.107 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 173.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.548 ' CE2' HD12 ' A' ' 57' ' ' ILE . 1.1 m-85 -128.83 118.78 23.32 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -176.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.408 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 70.3 m95 -59.38 140.14 56.39 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 123.804 0.842 . . . . 0.0 112.018 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -119.53 174.48 4.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 169.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.646 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.84 58.54 3.48 Favored Glycine 0 C--O 1.205 -1.703 0 CA-C-N 119.294 0.952 . . . . 0.0 113.76 -175.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.9 mt -127.44 113.86 16.74 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 123.743 0.817 . . . . 0.0 111.282 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -122.42 137.65 54.8 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -93.52 113.06 25.09 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 9.3 p . . . . . 0 C--N 1.293 -1.875 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.413 -174.858 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 10.9 m120 . . . . . 0 CA--C 1.498 -1.056 0 CA-C-O 120.89 0.376 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -87.88 125.4 34.46 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 176.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -124.0 155.3 38.49 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 119.689 -0.804 . . . . 0.0 111.125 175.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.646 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 19.3 m95 -90.53 176.01 6.85 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 114.548 -1.205 . . . . 0.0 108.522 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.486 HD11 ' HB ' ' A' ' 40' ' ' THR . 49.8 pt -72.71 -15.48 17.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -177.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.454 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 30.5 p-10 -88.11 -7.97 56.14 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.73 8.08 62.44 Favored Glycine 0 N--CA 1.444 -0.816 0 CA-C-N 114.771 -1.104 . . . . 0.0 113.766 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.4 t -81.09 167.82 19.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.323 0.562 . . . . 0.0 109.613 -179.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.1 m -90.46 139.68 30.45 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.551 HD11 HD12 ' A' ' 92' ' ' ILE . 35.0 tp -55.18 138.99 43.48 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.015 173.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.481 ' OD1' HG13 ' A' ' 89' ' ' VAL . 26.4 t-20 -98.29 91.46 5.24 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 170.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 39.5 p -71.88 -4.92 30.89 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.3 0.572 . . . . 0.0 111.849 -177.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -75.43 -18.13 59.99 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.555 -178.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.505 ' HA ' ' NE2' ' A' ' 47' ' ' GLN . 33.6 m -75.41 -55.47 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.511 0 C-N-CA 119.111 -1.036 . . . . 0.0 112.494 -177.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.514 HD12 HD13 ' A' ' 50' ' ' LEU . 87.0 mt -145.51 -177.8 5.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.014 0.435 . . . . 0.0 111.344 -172.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.561 ' O ' ' HB ' ' A' ' 109' ' ' VAL . 10.7 tptm -57.72 98.69 0.03 OUTLIER 'General case' 0 C--O 1.208 -1.093 0 C-N-CA 125.866 1.666 . . . . 0.0 112.182 176.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.551 HD12 HD11 ' A' ' 85' ' ' LEU . 4.8 mt -150.69 111.02 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.911 0 N-CA-C 106.822 -1.548 . . . . 0.0 106.822 171.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.1 m -71.45 133.7 46.07 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 177.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.81 -53.99 3.2 Favored Glycine 0 CA--C 1.47 -2.753 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -173.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -96.87 132.02 43.03 Favored 'General case' 0 N--CA 1.421 -1.894 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.9 t -152.25 -19.92 0.17 Allowed 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.804 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 60.88 36.14 19.04 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 123.964 0.906 . . . . 0.0 113.377 178.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -117.47 171.73 7.8 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.693 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -93.85 28.32 2.43 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 125.762 1.625 . . . . 0.0 108.021 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.401 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 66.8 m -84.11 155.73 22.49 Favored 'General case' 0 N--CA 1.422 -1.854 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -169.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 84.0 m -131.63 149.33 52.53 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 105.858 -1.904 . . . . 0.0 105.858 171.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -91.09 146.45 23.83 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -173.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.48 144.84 32.16 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.588 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' A' ' 63' ' ' SER . 7.7 mm -77.33 124.74 36.29 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 177.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.479 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 23.3 t -94.07 -43.21 8.61 Favored 'General case' 0 N--CA 1.414 -2.233 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 173.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.52 -109.36 0.22 Allowed Glycine 0 N--CA 1.418 -2.563 0 N-CA-C 109.12 -1.592 . . . . 0.0 109.12 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -75.81 -19.16 59.16 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -110.89 154.47 24.0 Favored 'General case' 0 C--O 1.259 1.589 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.201 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.561 ' HB ' ' O ' ' A' ' 91' ' ' LYS . 23.6 t -106.0 130.03 58.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 175.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.0 p -130.94 151.65 51.13 Favored 'General case' 0 C--N 1.27 -2.887 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -174.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.401 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 19.7 p90 -126.83 133.11 50.83 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 -173.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -129.46 174.51 9.57 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . 0.471 ' HB3' ' ND2' ' A' ' 115' ' ' ASN . 19.7 m -53.94 129.96 35.84 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.76 0.662 . . . . 0.0 109.224 174.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.2 m -58.87 -20.55 52.18 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.864 0.866 . . . . 0.0 112.33 -174.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . 0.471 ' ND2' ' HB3' ' A' ' 113' ' ' SER . 9.7 p30 -80.6 -9.08 59.8 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.291 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 51.0 p -68.02 144.8 54.98 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 120.346 -0.541 . . . . 0.0 110.753 -177.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -80.84 89.32 5.83 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.504 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' ASN . . . . . 0.549 ' OD1' ' HB2' ' A' ' 63' ' ' SER . 35.1 m-80 -125.92 170.48 11.63 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.449 -178.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.73 ' HB3' ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -89.82 179.6 5.95 Favored 'General case' 0 C--N 1.287 -2.117 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 -178.304 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.411 ' CZ3' HG23 ' A' ' 23' ' ' VAL . 17.9 p90 -153.24 165.01 37.06 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.757 1.162 . . . . 0.0 112.201 -175.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.433 HD13 HD12 ' A' ' 53' ' ' LEU . 80.8 mt -120.18 127.31 75.89 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.973 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 70.9 m -106.89 142.58 36.29 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.418 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.3 pt20 -124.18 135.93 53.82 Favored 'General case' 0 N--CA 1.417 -2.093 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 171.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -108.94 109.25 20.28 Favored 'General case' 0 C--N 1.254 -3.554 0 N-CA-C 105.411 -2.07 . . . . 0.0 105.411 174.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -68.62 124.4 23.5 Favored 'General case' 0 N--CA 1.414 -2.241 0 N-CA-C 104.499 -2.408 . . . . 0.0 104.499 174.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.709 HD13 ' SG ' ' A' ' 17' ' ' CYS . 6.8 tp . . . . . 0 C--N 1.284 -2.261 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.598 -166.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.522 ' HB2' ' HB3' ' A' ' 126' ' ' LEU . 5.0 mp . . . . . 0 C--O 1.244 0.769 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -95.34 141.17 29.22 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.583 0.706 . . . . 0.0 111.343 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . 0.485 ' HB3' HD11 ' A' ' 126' ' ' LEU . 14.6 p -125.95 170.76 8.9 Favored Pre-proline 0 C--N 1.29 -2.006 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.026 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.647 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 52.3 Cg_exo -58.42 152.77 51.99 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 122.855 2.37 . . . . 0.0 112.487 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -58.55 -31.63 68.14 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 -171.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -89.92 8.68 31.03 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.405 0.622 . . . . 0.0 110.641 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.647 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 31.8 m95 -111.4 131.23 55.35 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.913 -176.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.7 mm? -85.2 117.71 24.31 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . 0.595 ' HA ' ' SG ' ' A' ' 17' ' ' CYS . 1.8 m -78.95 123.59 27.42 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.96 -175.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 27.7 t-80 -145.29 114.11 6.86 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 122.019 -0.425 . . . . 0.0 110.044 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 56.6 mtp180 71.02 -85.17 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.31 1.044 . . . . 0.0 111.88 176.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -146.42 19.2 1.36 Allowed 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 123.816 0.847 . . . . 0.0 109.98 -176.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.51 ' HG2' ' NE2' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -143.56 160.33 40.82 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 175.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.595 ' SG ' ' HA ' ' A' ' 12' ' ' SER . 79.3 m -125.99 142.3 51.58 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 173.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -110.8 144.04 40.41 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.738 0.304 . . . . 0.0 111.684 -171.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -123.25 109.07 13.5 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 176.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.7 t -83.92 91.94 2.86 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.731 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 6.5 m -78.33 105.84 9.85 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.536 HE22 ' ND2' ' A' ' 62' ' ' ASN . 12.3 mm100 -77.49 14.43 1.0 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.47 1.108 . . . . 0.0 112.65 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.536 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.0 m -108.62 157.92 8.66 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.932 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.4 m -106.84 156.77 18.33 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -171.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 33.4 m-20 -167.81 175.29 6.96 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 128.024 2.53 . . . . 0.0 107.948 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.1 p -82.01 176.61 9.4 Favored 'General case' 0 C--O 1.257 1.471 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 171.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -61.81 -50.86 70.62 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.276 49.1 mt-10 -67.68 -30.62 70.19 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.81 -49.26 68.89 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.818 -0.753 . . . . 0.0 110.965 172.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.85 -33.9 86.93 Favored Glycine 0 C--N 1.339 0.741 0 N-CA-C 111.522 -0.631 . . . . 0.0 111.522 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.33 -52.87 62.07 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.848 0.859 . . . . 0.0 108.992 176.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.48 -31.8 52.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.198 0.523 . . . . 0.0 111.019 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.441 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 1.0 OUTLIER -62.46 -36.38 82.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.487 176.625 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.3 m -68.1 -41.09 82.32 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 175.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -57.36 -35.92 70.56 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.413 0.625 . . . . 0.0 109.622 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -63.08 -14.54 53.63 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 115.013 -0.994 . . . . 0.0 114.061 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . 0.441 ' HD2' ' O ' ' A' ' 33' ' ' ASP . 3.3 mptp? -108.36 3.54 23.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 117.622 0.711 . . . . 0.0 110.644 176.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.87 28.79 66.2 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -174.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -118.51 176.84 5.06 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 124.261 1.024 . . . . 0.0 108.705 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -123.52 149.69 44.9 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.56 125.57 25.61 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 177.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.4 tpt -26.62 121.98 0.08 Allowed 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 116.732 2.123 . . . . 0.0 116.732 -169.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.441 HD12 ' HB3' ' A' ' 79' ' ' TRP . 2.8 mm? -112.16 105.27 13.57 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.927 1.291 . . . . 0.0 107.599 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.481 HD13 HD11 ' A' ' 50' ' ' LEU . 56.5 mt -85.3 117.94 31.29 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.134 -175.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -82.5 -54.49 5.15 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.265 0.555 . . . . 0.0 111.404 179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.583 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 17.1 m-20 -137.04 -179.02 5.46 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 122.119 -0.363 . . . . 0.0 111.072 -171.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -39.63 80.72 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 -178.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -58.71 -28.26 65.65 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.792 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.583 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 6.5 mm-40 -60.21 -55.18 36.9 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 175.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.638 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 46.3 mt -68.85 -26.09 64.97 Favored 'General case' 0 C--O 1.202 -1.424 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -177.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -64.25 -38.32 90.63 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.308 -0.557 . . . . 0.0 109.694 174.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -73.1 -28.5 62.32 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.63 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -66.22 -51.89 53.2 Favored 'General case' 0 C--O 1.183 -2.425 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 174.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 50.9 mt -54.8 -33.36 61.39 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -72.89 -46.21 53.98 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.543 174.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.3 p -75.53 -27.04 58.54 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.127 0.489 . . . . 0.0 111.831 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.63 HG12 ' O ' ' A' ' 53' ' ' LEU . 34.2 mm -58.7 -48.92 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.243 174.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? 67.99 -66.41 0.22 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.037 0.935 . . . . 0.0 112.667 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -62.01 -51.28 68.67 Favored 'General case' 0 C--O 1.207 -1.142 0 C-N-CA 123.842 0.857 . . . . 0.0 111.131 -176.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.51 ' H ' HG22 ' A' ' 57' ' ' ILE . 3.8 ttmp? 71.31 -40.85 0.49 Allowed 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -80.81 37.68 0.43 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.787 0.803 . . . . 0.0 112.911 -174.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.607 ' O ' ' HA ' ' A' ' 105' ' ' SER . 54.2 m-80 -124.97 -158.88 0.85 Allowed 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 176.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.46 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 15.3 m -143.28 117.82 9.75 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.521 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 2.2 m-85 -122.56 117.5 26.03 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -63.15 139.77 58.81 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 123.063 0.545 . . . . 0.0 111.428 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -117.76 172.76 5.09 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 168.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.59 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -74.92 44.09 1.5 Allowed Glycine 0 C--O 1.216 -1.01 0 CA-C-N 119.132 0.878 . . . . 0.0 114.544 -174.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.509 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 28.8 mt -114.37 123.68 50.07 Favored 'General case' 0 CA--C 1.483 -1.614 0 C-N-CA 123.793 0.837 . . . . 0.0 111.898 -178.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -142.52 140.69 31.91 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 120.086 -0.645 . . . . 0.0 110.076 171.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.558 ' HD2' ' O ' ' A' ' 98' ' ' ASN . 82.9 t80 -83.02 113.21 20.43 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 32.5 p . . . . . 0 C--N 1.283 -2.284 0 C-N-CA 119.856 -0.738 . . . . 0.0 112.325 -173.754 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 14.8 m120 . . . . . 0 C--O 1.255 1.35 0 CA-C-O 121.26 0.552 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.507 ' HE1' ' HA2' ' A' ' 94' ' ' GLY . 83.0 m95 -88.92 112.71 23.63 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 173.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -116.86 154.64 30.41 Favored 'General case' 0 C--N 1.278 -2.504 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.922 -176.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.59 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 47.2 m95 -98.55 165.5 11.79 Favored 'General case' 0 N--CA 1.425 -1.722 0 CA-C-N 114.504 -1.225 . . . . 0.0 109.353 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.1 pt -73.28 -13.76 16.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.063 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -92.61 -0.66 57.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.396 0.617 . . . . 0.0 109.844 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.46 -2.72 57.59 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.016 -0.993 . . . . 0.0 114.256 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.1 t -84.82 170.6 13.01 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 117.609 0.705 . . . . 0.0 109.852 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.3 m -112.15 145.49 39.72 Favored 'General case' 0 N--CA 1.419 -2.004 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 43.0 tp -53.86 131.98 40.87 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -178.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -86.51 87.85 7.52 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 168.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.2 m -64.18 -10.88 25.82 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.923 -177.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -77.72 -6.56 54.41 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 22.6 m -74.32 -48.96 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 118.764 -1.174 . . . . 0.0 111.924 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.2 mt -156.72 -178.09 7.09 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 -175.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -73.49 123.31 23.67 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.0 mt -142.59 132.33 22.6 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 N-CA-C 105.721 -1.955 . . . . 0.0 105.721 171.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.2 m -112.71 131.94 55.43 Favored 'General case' 0 C--N 1.288 -2.083 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.192 -173.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.507 ' HA2' ' HE1' ' A' ' 77' ' ' TRP . . . -91.87 -14.46 56.44 Favored Glycine 0 N--CA 1.426 -2.028 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -77.25 111.16 12.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 174.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 98' ' ' ASN . 5.5 t -171.32 -42.86 0.02 OUTLIER 'General case' 0 C--N 1.274 -2.674 0 CA-C-N 114.473 -1.239 . . . . 0.0 108.43 -175.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 68.09 19.06 9.34 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.145 1.378 . . . . 0.0 111.373 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.558 ' O ' ' HD2' ' A' ' 70' ' ' TYR . 26.3 m-80 -121.71 152.9 38.9 Favored 'General case' 0 CA--C 1.498 -1.048 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -72.16 30.46 0.05 Allowed 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 126.346 1.858 . . . . 0.0 110.527 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.452 ' H ' ' C ' ' A' ' 98' ' ' ASN . 41.0 t -62.36 149.07 43.35 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 126.14 1.776 . . . . 0.0 112.802 -172.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 90.1 m -112.92 145.31 40.97 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.067 -0.969 . . . . 0.0 108.794 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.481 ' HB1' HG12 ' A' ' 109' ' ' VAL . . . -98.0 147.2 24.74 Favored 'General case' 0 C--O 1.255 1.364 0 CA-C-O 121.3 0.571 . . . . 0.0 111.898 -176.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -139.53 152.21 46.74 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.486 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.46 ' O ' ' HA ' ' A' ' 63' ' ' SER . 17.3 mm -77.85 112.53 15.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 N-CA-C 105.388 -2.079 . . . . 0.0 105.388 172.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.607 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 8.5 t -131.82 33.53 3.96 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-O 122.376 1.084 . . . . 0.0 108.511 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.66 -139.82 6.65 Favored Glycine 0 N--CA 1.412 -2.913 0 N-CA-C 108.277 -1.929 . . . . 0.0 108.277 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.433 ' OD2' ' HE3' ' A' ' 108' ' ' LYS . 14.2 p-10 -98.99 8.82 44.64 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.433 ' HE3' ' OD2' ' A' ' 107' ' ' ASP . 32.4 mmtp -130.43 163.65 26.46 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.102 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.481 HG12 ' HB1' ' A' ' 102' ' ' ALA . 2.8 t -99.11 119.83 47.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.1 p -122.04 143.78 49.3 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.41 ' HA ' ' HA ' ' A' ' 102' ' ' ALA . 23.6 p90 -109.67 145.86 35.8 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -135.76 175.43 9.6 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.79 -1.096 . . . . 0.0 109.942 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.3 m -67.57 127.06 31.33 Favored 'General case' 0 N--CA 1.413 -2.305 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 171.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 20.5 m -56.33 -21.79 26.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.465 0.706 . . . . 0.0 112.585 -173.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -77.15 -3.46 39.59 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 30.6 p -75.97 140.39 42.02 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 119.316 0.962 . . . . 0.0 111.389 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.58 89.1 7.05 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.546 0.689 . . . . 0.0 109.444 -177.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -120.78 174.38 6.63 Favored 'General case' 0 C--O 1.196 -1.759 0 C-N-CA 124.563 1.145 . . . . 0.0 109.832 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.731 ' HB3' ' O ' ' A' ' 21' ' ' SER . 3.4 mpt_? -85.87 -178.77 6.67 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -176.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 24.8 p90 -153.18 162.77 40.93 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 118.688 -1.205 . . . . 0.0 111.999 -176.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 75.6 mt -120.13 125.57 74.37 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-O 121.237 0.542 . . . . 0.0 109.856 178.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 71.7 m -105.24 145.25 30.9 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 176.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.51 ' NE2' ' HG2' ' A' ' 16' ' ' LYS . 8.7 pt20 -122.61 133.5 54.54 Favored 'General case' 0 N--CA 1.412 -2.326 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 171.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -110.66 108.0 17.76 Favored 'General case' 0 N--CA 1.397 -3.124 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 173.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.462 ' HA ' ' HA ' ' A' ' 16' ' ' LYS . 42.3 tt0 -68.74 134.43 49.77 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-N 113.989 -1.459 . . . . 0.0 108.365 -177.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.522 ' HB3' ' HB2' ' A' ' 4' ' ' LEU . 1.7 mm? . . . . . 0 C--N 1.31 -1.11 0 CA-C-O 121.782 0.801 . . . . 0.0 109.404 178.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.561 HD13 ' HB3' ' A' ' 126' ' ' LEU . 5.0 mp . . . . . 0 N--CA 1.426 -1.657 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -80.67 140.52 35.6 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.766 0.793 . . . . 0.0 112.583 -176.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.8 p -128.18 165.92 27.52 Favored Pre-proline 0 C--N 1.296 -1.759 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.517 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.695 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 52.4 Cg_exo -54.08 162.16 4.34 Favored 'Trans proline' 0 C--N 1.373 1.826 0 C-N-CA 123.222 2.615 . . . . 0.0 115.084 -178.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -59.78 -35.49 74.75 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 115.212 1.56 . . . . 0.0 115.212 -173.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -89.7 3.08 53.85 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -175.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.695 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 16.9 m95 -101.11 153.11 19.86 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.628 -171.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -108.38 124.4 50.31 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.8 p -90.82 126.61 36.08 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -176.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.463 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 54.1 t-80 -146.21 115.13 6.93 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 123.002 0.521 . . . . 0.0 110.086 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.25 3.9 mpt_? 53.58 59.14 4.53 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 174.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.5 m-20 62.65 24.83 14.78 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.446 174.627 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -145.67 148.01 32.6 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.407 ' SG ' ' HB3' ' A' ' 10' ' ' TRP . 7.3 t -130.78 134.48 46.9 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -176.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.463 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 11.8 m-85 -111.77 149.87 31.09 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -170.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.512 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 45.3 t-80 -129.52 116.94 19.68 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 172.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.01 93.57 3.87 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 174.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.726 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 13.3 m -77.8 107.76 10.54 Favored 'General case' 0 N--CA 1.416 -2.159 0 CA-C-N 115.306 -0.861 . . . . 0.0 108.696 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.439 HE22 ' ND2' ' A' ' 62' ' ' ASN . 11.5 mm100 -83.55 13.92 4.17 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.603 0.716 . . . . 0.0 111.15 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.478 HG23 ' CH2' ' A' ' 120' ' ' TRP . 5.7 m -100.62 158.32 3.99 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.149 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 118' ' ' ASN . 13.2 m -109.97 151.59 26.93 Favored 'General case' 0 C--N 1.294 -1.81 0 C-N-CA 118.776 -1.17 . . . . 0.0 114.091 -171.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -167.09 174.66 8.11 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 127.39 2.276 . . . . 0.0 108.426 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.5 p -86.37 171.89 10.83 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 107.443 -1.318 . . . . 0.0 107.443 170.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -56.54 -52.99 62.68 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -174.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -31.26 70.38 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.956 0.408 . . . . 0.0 111.779 -175.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -70.23 -45.25 66.89 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.888 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.88 -32.04 82.83 Favored Glycine 0 C--N 1.341 0.824 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.403 ' HA ' ' HB2' ' A' ' 41' ' ' LEU . 5.0 tt -56.42 -51.21 69.24 Favored 'General case' 0 C--O 1.242 0.682 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 176.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.1 t -67.8 -33.24 60.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.839 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -60.11 -37.06 78.87 Favored 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 82.9 m -65.32 -42.35 93.07 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -61.16 -27.73 68.61 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.194 177.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -58.64 -34.98 78.89 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.576 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -95.73 8.93 42.09 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 122.26 -0.553 . . . . 0.0 109.704 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.8 43.67 93.58 Favored Glycine 0 CA--C 1.503 -0.68 0 N-CA-C 109.695 -1.362 . . . . 0.0 109.695 -175.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -130.05 174.91 9.33 Favored 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 -177.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -119.29 150.83 39.47 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 118.454 0.57 . . . . 0.0 110.972 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 25.9 tp -65.6 124.74 23.17 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 175.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.1 tpt -29.98 120.01 0.17 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 -169.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.404 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 2.9 mm? -109.3 110.6 21.82 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 114.191 -1.368 . . . . 0.0 107.505 176.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.9 mt -96.96 117.66 41.93 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -175.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.401 HE22 ' HB3' ' A' ' 43' ' ' LEU . 2.1 mp0 -100.2 -25.1 14.38 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -137.05 160.42 39.01 Favored 'General case' 0 CA--C 1.5 -0.973 0 CA-C-O 120.669 0.271 . . . . 0.0 110.77 -175.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -33.97 74.93 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.3 mp0 -58.6 -29.39 66.42 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.04 178.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -62.17 -54.45 40.86 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.647 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 58.1 mt -65.28 -26.01 67.9 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -62.9 -41.6 99.49 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -72.45 -28.06 62.7 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.611 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -64.11 -50.75 67.03 Favored 'General case' 0 C--O 1.18 -2.603 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 175.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 51.1 mt -54.86 -35.18 63.74 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 122.878 0.471 . . . . 0.0 111.974 -178.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.04 -42.34 73.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.296 -0.411 . . . . 0.0 112.102 175.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.6 p -81.63 -26.43 34.82 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.204 0.526 . . . . 0.0 112.283 -176.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.611 HG12 ' O ' ' A' ' 53' ' ' LEU . 35.4 mm -64.08 -47.36 90.56 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 tptt 67.1 -68.98 0.14 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.689 1.196 . . . . 0.0 112.62 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -65.48 -47.59 75.55 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -175.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.475 ' H ' HG22 ' A' ' 57' ' ' ILE . 96.0 mttt 75.17 -39.28 0.4 Allowed 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.639 1.176 . . . . 0.0 113.923 177.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -73.29 37.84 0.09 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -173.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.575 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 60.9 m-80 -128.0 -163.1 1.23 Allowed 'General case' 0 C--N 1.277 -2.578 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 174.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.618 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 50.3 m -139.16 119.54 13.81 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 176.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.575 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 6.2 m-85 -120.91 116.17 24.62 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -177.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.425 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 71.5 m95 -61.81 138.85 58.37 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 123.596 0.758 . . . . 0.0 111.492 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.14 175.63 4.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.149 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 168.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.645 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.04 47.96 2.33 Favored Glycine 0 C--O 1.209 -1.438 0 C-N-CA 120.784 -0.722 . . . . 0.0 114.375 -174.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.7 mt -114.25 121.72 44.57 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 123.283 0.633 . . . . 0.0 111.843 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -129.4 134.29 47.79 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.226 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -87.39 112.82 22.52 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 179.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.516 ' OG1' ' HE2' ' A' ' 78' ' ' LYS . 46.6 p . . . . . 0 C--N 1.307 -1.275 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.128 -172.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.7 m120 . . . . . 0 N--CA 1.433 -1.283 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.405 ' HE1' ' HA2' ' A' ' 94' ' ' GLY . 77.5 m95 -86.93 119.93 27.67 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 175.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . 0.516 ' HE2' ' OG1' ' A' ' 71' ' ' THR . 55.9 mttm -113.22 152.29 29.94 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -177.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.645 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 42.5 m95 -98.03 175.91 5.95 Favored 'General case' 0 C--N 1.288 -2.094 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 46.0 pt -71.93 -23.2 21.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 120.95 0.405 . . . . 0.0 111.334 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.3 p-10 -85.69 -9.68 56.83 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.628 0.728 . . . . 0.0 109.69 179.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.21 -0.08 44.11 Favored Glycine 0 CA--C 1.495 -1.18 0 CA-C-N 115.39 -0.823 . . . . 0.0 112.382 172.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.1 m -69.8 168.22 15.56 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 28.8 m -108.94 134.43 51.61 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.622 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.496 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 44.3 tp -54.45 142.27 27.85 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 124.84 1.256 . . . . 0.0 114.047 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -96.12 97.1 9.3 Favored 'General case' 0 N--CA 1.432 -1.335 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 169.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.1 m -70.65 -6.11 34.53 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.222 0.534 . . . . 0.0 111.328 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -78.3 -6.21 54.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.079 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.3 m -78.74 -54.47 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.31 0 C-N-CA 119.364 -0.934 . . . . 0.0 112.195 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 91.5 mt -157.37 -178.16 7.14 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.577 0.751 . . . . 0.0 109.188 -174.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.6 98.47 0.37 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -177.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.406 HD12 HD11 ' A' ' 85' ' ' LEU . 8.8 mt -139.23 103.54 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 173.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.491 HG22 ' H ' ' A' ' 95' ' ' ASP . 9.7 m -76.05 132.31 40.03 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.086 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . 0.405 ' HA2' ' HE1' ' A' ' 77' ' ' TRP . . . -106.26 12.61 44.14 Favored Glycine 0 CA--C 1.489 -1.559 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -177.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.491 ' H ' HG22 ' A' ' 93' ' ' THR . 7.2 p-10 -140.97 96.73 3.05 Favored 'General case' 0 C--N 1.285 -2.219 0 CA-C-O 121.557 0.694 . . . . 0.0 109.64 176.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.1 t -148.43 -20.48 0.33 Allowed 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.396 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 56.81 82.08 0.12 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.983 0.913 . . . . 0.0 112.888 -177.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -157.0 178.06 10.8 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -108.83 26.17 10.89 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 123.137 1.446 . . . . 0.0 107.475 179.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.451 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 19.1 m -66.75 153.42 43.33 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -173.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -132.88 145.71 51.17 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 113.606 -1.634 . . . . 0.0 107.0 173.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -92.16 148.24 22.31 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -171.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.49 153.32 42.5 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.48 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 63' ' ' SER . 14.2 mm -77.7 120.14 27.75 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 174.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 34.1 t -134.97 94.21 3.12 Favored 'General case' 0 N--CA 1.421 -1.881 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.24 -126.41 8.09 Favored Glycine 0 N--CA 1.429 -1.825 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -102.3 8.39 40.38 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -126.74 166.83 16.66 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.263 -173.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 t -104.85 133.51 48.82 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.753 0 N-CA-C 104.766 -2.309 . . . . 0.0 104.766 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 43.2 p -127.98 170.47 12.83 Favored 'General case' 0 C--N 1.278 -2.501 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.451 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 11.3 p90 -130.35 125.28 34.23 Favored 'General case' 0 C--N 1.296 -1.758 0 C-N-CA 119.619 -0.832 . . . . 0.0 112.598 178.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -118.06 170.82 8.54 Favored 'General case' 0 C--N 1.294 -1.824 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.712 -172.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 19.1 m -72.0 127.84 33.82 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 170.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.6 m -50.71 -22.14 1.95 Allowed 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 125.495 1.518 . . . . 0.0 113.553 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.51 7.43 9.93 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 124.387 1.075 . . . . 0.0 111.561 -175.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 18.5 p -92.13 140.38 29.69 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.582 -0.699 . . . . 0.0 111.777 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -78.65 90.42 4.58 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.8 0.81 . . . . 0.0 109.294 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' ASN . . . . . 0.406 ' O ' ' HA ' ' A' ' 24' ' ' SER . 82.8 m-20 -126.61 -178.58 4.42 Favored 'General case' 0 C--O 1.196 -1.746 0 CA-C-N 114.94 -1.027 . . . . 0.0 108.991 -178.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.726 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.7 mpt_? -100.85 -175.44 2.89 Favored 'General case' 0 C--N 1.283 -2.293 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 -175.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.478 ' CH2' HG23 ' A' ' 23' ' ' VAL . 26.9 p90 -154.27 169.69 23.05 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 119.492 1.042 . . . . 0.0 112.199 -176.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.403 HG13 ' HB3' ' A' ' 64' ' ' PHE . 74.2 mt -122.22 125.74 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 CA-C-O 121.4 0.619 . . . . 0.0 109.855 178.142 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 87.0 m -104.1 142.82 33.8 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.448 -0.796 . . . . 0.0 108.929 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -117.93 132.76 56.37 Favored 'General case' 0 N--CA 1.413 -2.305 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 172.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . 0.541 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 42.9 tttp -109.98 106.49 16.03 Favored 'General case' 0 C--N 1.251 -3.7 0 N-CA-C 104.048 -2.575 . . . . 0.0 104.048 173.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -83.53 124.73 31.04 Favored 'General case' 0 N--CA 1.41 -2.437 0 CA-C-N 114.357 -1.292 . . . . 0.0 109.902 -170.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.561 ' HB3' HD13 ' A' ' 4' ' ' LEU . 1.5 mm? . . . . . 0 N--CA 1.43 -1.451 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.264 -175.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.6 mp . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 107.792 -1.188 . . . . 0.0 107.792 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -94.31 145.03 25.03 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 118.419 0.554 . . . . 0.0 111.189 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 71.0 m -113.25 164.08 16.55 Favored Pre-proline 0 C--N 1.301 -1.511 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.475 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 38.5 Cg_exo -60.75 157.67 36.6 Favored 'Trans proline' 0 C--N 1.368 1.573 0 C-N-CA 121.448 1.432 . . . . 0.0 110.956 174.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -44.13 -45.35 8.17 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -92.47 2.18 56.82 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.513 -172.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.475 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 23.9 m95 -99.98 126.87 46.22 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.793 0.806 . . . . 0.0 111.788 -173.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.2 tp -84.69 119.41 25.22 Favored 'General case' 0 N--CA 1.412 -2.347 0 CA-C-N 113.753 -1.567 . . . . 0.0 108.081 -175.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.6 t -92.72 130.79 38.23 Favored 'General case' 0 C--N 1.272 -2.781 0 CA-C-O 120.897 0.38 . . . . 0.0 111.092 -173.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.459 ' CE1' ' HG2' ' A' ' 14' ' ' ARG . 48.3 t-80 -153.31 130.03 10.83 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 123.212 0.605 . . . . 0.0 109.696 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.459 ' HG2' ' CE1' ' A' ' 13' ' ' HIS . 24.0 mmt180 65.11 -81.04 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.439 1.495 . . . . 0.0 113.011 178.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -157.77 26.07 0.27 Allowed 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 -174.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -141.98 163.75 32.03 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.441 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.676 ' SG ' HD13 ' A' ' 126' ' ' LEU . 13.1 m -123.96 131.07 53.51 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 176.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.432 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 22.6 m-85 -111.15 135.73 51.23 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 120.999 0.428 . . . . 0.0 111.907 -175.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -121.53 102.08 8.02 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 173.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -81.1 95.18 2.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.753 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 9.4 m -77.77 108.03 10.71 Favored 'General case' 0 N--CA 1.414 -2.248 0 CA-C-N 115.416 -0.811 . . . . 0.0 108.98 -178.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.524 HE22 ' ND2' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -83.34 14.79 3.34 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.997 0.919 . . . . 0.0 112.67 -179.409 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.472 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.4 m -105.7 158.89 6.02 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.801 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 178.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -111.4 148.38 33.18 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -171.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -158.15 -176.69 6.06 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 127.379 2.272 . . . . 0.0 107.825 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.7 p -84.68 176.62 8.45 Favored 'General case' 0 C--O 1.258 1.525 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 171.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.9 t90 -63.02 -47.0 84.93 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.443 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 43.1 mt-10 -67.76 -38.01 82.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.946 -177.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.33 -46.07 85.13 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.456 -0.498 . . . . 0.0 111.429 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.9 -35.66 92.33 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 120.165 -1.017 . . . . 0.0 111.574 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 3.2 tm? -55.39 -52.16 64.45 Favored 'General case' 0 C--O 1.249 1.043 0 C-N-CA 123.797 0.839 . . . . 0.0 108.999 176.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 84.8 t -68.1 -32.59 56.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.971 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.8 -36.35 80.86 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.783 177.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.0 m -69.38 -40.37 77.47 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -60.44 -29.42 69.0 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.369 0.604 . . . . 0.0 109.589 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -60.76 -30.24 72.16 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.248 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -96.8 1.86 51.21 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 117.245 0.522 . . . . 0.0 111.027 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.0 53.28 9.55 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 108.53 -1.828 . . . . 0.0 108.53 -172.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -147.3 177.28 9.34 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.437 ' HB ' HD11 ' A' ' 80' ' ' ILE . 11.2 p -120.85 159.56 25.24 Favored 'General case' 0 C--N 1.284 -2.28 0 C-N-CA 122.917 0.487 . . . . 0.0 110.402 -176.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.7 tp -73.97 131.62 41.59 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 174.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.4 tpt -29.38 122.7 0.15 Allowed 'General case' 0 N--CA 1.506 2.333 0 N-CA-C 116.77 2.137 . . . . 0.0 116.77 -170.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.481 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 2.9 mm? -112.94 108.09 16.89 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.552 HD13 HD11 ' A' ' 50' ' ' LEU . 54.4 mt -83.38 118.15 30.43 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.7 0 O-C-N 122.211 -0.305 . . . . 0.0 110.556 -175.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -79.73 -45.79 18.26 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.16 -178.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -154.15 179.85 8.56 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -174.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.3 -36.27 79.08 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -60.3 -27.89 67.67 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.498 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -68.17 -52.13 38.05 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.554 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.4 mt -66.22 -24.26 66.58 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -64.71 -35.93 82.65 Favored 'General case' 0 N--CA 1.393 -3.285 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -72.1 -31.74 66.34 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.265 175.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.607 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.4 mm? -64.21 -52.67 57.69 Favored 'General case' 0 C--O 1.192 -1.922 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 45.4 mt -54.77 -40.63 69.59 Favored 'General case' 0 C--O 1.252 1.233 0 C-N-CA 123.178 0.591 . . . . 0.0 112.246 -177.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -70.2 -36.8 74.85 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 178.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.8 p -81.96 -33.55 30.19 Favored 'General case' 0 C--N 1.31 -1.152 0 C-N-CA 120.824 -0.351 . . . . 0.0 111.451 -178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.1 mm -56.07 -45.97 80.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.609 0 C-N-CA 123.878 0.871 . . . . 0.0 109.545 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? 66.12 -68.64 0.13 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.435 1.094 . . . . 0.0 113.093 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -60.36 -38.64 84.5 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 124.656 1.183 . . . . 0.0 114.182 -174.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.536 ' H ' HG22 ' A' ' 57' ' ' ILE . 41.8 mmtm 71.94 -53.34 0.69 Allowed 'General case' 0 C--O 1.212 -0.913 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 175.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -67.3 35.16 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 126.321 1.848 . . . . 0.0 114.494 -171.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.524 ' ND2' HE22 ' A' ' 22' ' ' GLN . 93.2 m-20 -127.49 -173.61 2.96 Favored 'General case' 0 C--N 1.273 -2.749 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 177.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.681 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 50.2 m -142.66 121.9 13.03 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 177.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.472 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 3.0 m-85 -123.64 117.6 25.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -176.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.403 ' CE2' ' HB2' ' A' ' 118' ' ' ASN . 78.9 m95 -60.77 139.02 58.05 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 123.53 0.732 . . . . 0.0 111.207 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -119.48 176.25 3.53 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 170.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.517 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.94 48.41 2.7 Favored Glycine 0 C--O 1.22 -0.745 0 CA-C-N 118.736 0.698 . . . . 0.0 114.128 -174.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.452 HD21 HD13 ' A' ' 85' ' ' LEU . 48.3 mt -113.1 115.42 28.28 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 123.295 0.638 . . . . 0.0 112.105 -179.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -126.22 146.81 49.83 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 173.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . 0.442 ' HD2' ' O ' ' A' ' 98' ' ' ASN . 30.0 t80 -96.37 113.19 24.76 Favored 'General case' 0 C--N 1.277 -2.582 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -177.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 17.1 p . . . . . 0 C--N 1.297 -1.7 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.69 -175.341 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 10.5 m120 . . . . . 0 N--CA 1.419 -2.003 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -92.62 138.14 31.76 Favored 'General case' 0 C--N 1.281 -2.399 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -177.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -118.87 152.42 36.31 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.611 ' HB2' ' OD1' ' A' ' 81' ' ' ASN . 23.7 m95 -98.2 170.76 8.66 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 115.463 -0.79 . . . . 0.0 108.909 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.437 HD11 ' HB ' ' A' ' 40' ' ' THR . 48.1 pt -73.23 -12.33 15.47 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.882 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.611 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 33.3 p-10 -86.17 -8.08 58.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.243 0.544 . . . . 0.0 109.665 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.39 6.48 57.54 Favored Glycine 0 CA--C 1.523 0.577 0 CA-C-N 114.903 -1.044 . . . . 0.0 113.473 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.5 t -96.05 174.16 7.06 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -178.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 59.3 m -106.55 145.55 31.72 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 121.256 0.551 . . . . 0.0 109.864 177.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.52 HD11 HD12 ' A' ' 92' ' ' ILE . 28.4 tp -54.23 144.21 20.77 Favored 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 125.987 1.715 . . . . 0.0 113.41 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -92.34 89.83 6.99 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 170.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.8 m -70.37 -12.24 61.45 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.486 -175.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -77.66 -10.66 59.64 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.435 -176.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.4 m -75.46 -51.28 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -176.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.0 mt -155.21 -177.96 6.91 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -173.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.413 ' HD2' ' HB3' ' A' ' 108' ' ' LYS . 0.0 OUTLIER -63.98 102.67 0.51 Allowed 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 114.72 1.378 . . . . 0.0 114.72 -179.064 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.52 HD12 HD11 ' A' ' 85' ' ' LEU . 7.7 mt -143.47 98.65 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 171.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.1 m -60.49 127.69 32.95 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.364 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.96 -43.8 5.89 Favored Glycine 0 N--CA 1.414 -2.808 0 N-CA-C 108.78 -1.728 . . . . 0.0 108.78 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -85.96 85.44 7.37 Favored 'General case' 0 N--CA 1.428 -1.575 0 CA-C-O 122.727 1.251 . . . . 0.0 110.925 177.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.1 t -122.16 -32.33 3.7 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.394 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 56.06 34.36 23.62 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.935 0.894 . . . . 0.0 111.811 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . 0.442 ' O ' ' HD2' ' A' ' 70' ' ' TYR . 35.1 m-80 -108.57 -171.7 1.91 Allowed 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.829 176.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -119.52 25.75 9.85 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-O 123.019 1.39 . . . . 0.0 107.299 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.424 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 22.9 t -73.9 157.65 35.89 Favored 'General case' 0 C--N 1.298 -1.65 0 CA-C-N 113.854 -1.521 . . . . 0.0 111.544 -174.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 72.2 m -121.59 144.89 48.48 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . 0.455 ' HA ' ' HA ' ' A' ' 111' ' ' PHE . . . -95.31 150.48 20.21 Favored 'General case' 0 C--O 1.251 1.15 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -173.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.19 154.43 43.85 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 124.571 1.148 . . . . 0.0 109.664 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.681 ' O ' ' HA ' ' A' ' 63' ' ' SER . 14.1 mm -77.65 116.27 20.87 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.354 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 173.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 6.4 t -129.3 93.11 3.49 Favored 'General case' 0 N--CA 1.405 -2.685 0 N-CA-C 106.749 -1.574 . . . . 0.0 106.749 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 87.79 -133.51 11.85 Favored Glycine 0 N--CA 1.431 -1.668 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . 0.487 ' OD2' ' HE2' ' A' ' 60' ' ' LYS . 8.1 m-20 -97.73 15.05 24.79 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 174.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . 0.413 ' HB3' ' HD2' ' A' ' 91' ' ' LYS . 29.8 mmtp -125.38 168.99 12.79 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.706 -174.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.2 t -115.53 133.32 62.25 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.003 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 173.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.7 p -129.15 167.79 17.08 Favored 'General case' 0 C--N 1.278 -2.514 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.455 ' HA ' ' HA ' ' A' ' 102' ' ' ALA . 6.2 p90 -122.74 128.08 50.04 Favored 'General case' 0 C--N 1.285 -2.234 0 CA-C-O 121.444 0.64 . . . . 0.0 111.105 176.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.401 ' HB2' ' CH2' ' A' ' 65' ' ' TRP . 21.4 mm-40 -120.81 170.02 9.86 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.805 -172.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.9 m -65.78 128.41 35.89 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 170.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 11.7 m -61.21 -18.91 60.64 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.242 0.617 . . . . 0.0 112.292 -172.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -88.84 0.16 56.8 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.935 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 64.7 p -80.32 150.09 30.05 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.989 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -76.76 106.15 8.25 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.142 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' ASN . . . . . 0.403 ' HB2' ' CE2' ' A' ' 65' ' ' TRP . 78.2 m-20 -143.67 172.46 12.79 Favored 'General case' 0 CA--C 1.489 -1.372 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.753 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.6 mpt_? -93.74 -174.82 3.56 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 -177.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 24.4 p90 -155.36 167.56 29.98 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 119.897 1.226 . . . . 0.0 111.619 -177.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.45 HD13 HD12 ' A' ' 53' ' ' LEU . 79.5 mt -124.06 123.55 66.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-O 121.234 0.54 . . . . 0.0 110.052 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 79.0 m -100.84 138.93 37.23 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.103 176.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.552 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.0 pt20 -123.43 140.49 52.95 Favored 'General case' 0 N--CA 1.413 -2.293 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 173.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -109.5 124.31 50.86 Favored 'General case' 0 C--N 1.246 -3.91 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 175.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -72.22 114.22 10.1 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 177.166 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.676 HD13 ' SG ' ' A' ' 17' ' ' CYS . 13.6 tp . . . . . 0 C--N 1.301 -1.501 0 CA-C-N 114.274 -1.33 . . . . 0.0 110.224 -171.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.8 mp . . . . . 0 CA--C 1.55 0.968 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -86.71 141.03 29.2 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 118.621 0.646 . . . . 0.0 112.178 -177.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.9 m -120.68 156.06 56.41 Favored Pre-proline 0 C--N 1.309 -1.186 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.955 177.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.492 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 15.4 Cg_exo -66.36 164.41 28.45 Favored 'Trans proline' 0 CA--C 1.55 1.279 0 C-N-CA 121.733 1.622 . . . . 0.0 111.344 174.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . 0.425 ' HG3' ' N ' ' A' ' 9' ' ' ASP . 11.4 pt20 -50.73 -46.1 58.92 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -173.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.425 ' N ' ' HG3' ' A' ' 8' ' ' GLN . 22.4 m-20 -92.74 24.29 3.67 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 120.749 0.309 . . . . 0.0 111.282 -173.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.492 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 26.6 m95 -122.17 131.98 54.22 Favored 'General case' 0 C--N 1.295 -1.802 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.527 -177.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.35 135.97 33.12 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 177.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.1 t -98.48 123.3 42.55 Favored 'General case' 0 C--N 1.292 -1.92 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.112 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.404 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 43.0 t-80 -130.39 108.15 9.77 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.938 -0.476 . . . . 0.0 110.949 179.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 59.59 -68.63 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 126.451 1.901 . . . . 0.0 113.642 177.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -147.8 19.66 1.15 Allowed 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.427 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.583 ' HG3' ' HA ' ' A' ' 125' ' ' GLU . 3.9 mppt? -150.87 151.99 33.03 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.231 0.612 . . . . 0.0 109.926 176.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.698 ' SG ' HD13 ' A' ' 126' ' ' LEU . 8.3 m -108.22 136.71 47.43 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 177.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.424 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 13.6 m-85 -113.27 142.0 46.34 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 118.669 0.668 . . . . 0.0 111.546 -176.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . 0.443 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 35.1 t60 -128.15 112.57 14.7 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 175.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.8 t -94.12 98.57 8.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.762 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 4.8 m -77.69 117.86 19.5 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.437 HE22 ' ND2' ' A' ' 62' ' ' ASN . 14.3 mm100 -86.97 14.39 7.46 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.855 0.836 . . . . 0.0 111.726 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.499 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 7.2 m -111.44 156.31 12.61 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.295 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 55.1 m -103.51 158.98 15.98 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -173.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 36.5 m-20 -162.96 170.98 17.25 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 127.716 2.407 . . . . 0.0 107.896 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.7 p -81.64 165.62 20.9 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 170.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -58.42 -50.95 71.86 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.737 0.699 . . . . 0.0 112.051 -174.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.443 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 38.6 mt-10 -66.26 -32.01 73.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.596 0.712 . . . . 0.0 110.793 -176.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -70.42 -44.56 67.65 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.454 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.33 -35.22 91.77 Favored Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 2.7 tm? -55.68 -52.26 64.45 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.77 -35.06 74.27 Favored 'Isoleucine or valine' 0 C--O 1.244 0.778 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.68 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.05 -36.5 81.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.726 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.6 m -67.44 -42.6 82.86 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 176.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.75 -23.11 67.03 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.217 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.96 -33.91 87.12 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.169 176.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -93.94 10.22 34.26 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.284 -0.539 . . . . 0.0 110.056 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 40.85 84.52 Favored Glycine 0 CA--C 1.495 -1.176 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.547 ' HB1' ' O ' ' A' ' 123' ' ' GLN . . . -131.28 176.79 7.99 Favored 'General case' 0 N--CA 1.416 -2.125 0 CA-C-N 114.723 -0.738 . . . . 0.0 109.29 -176.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -117.62 162.14 18.51 Favored 'General case' 0 C--N 1.284 -2.269 0 C-N-CA 123.24 0.616 . . . . 0.0 109.571 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.3 tp -81.1 121.95 26.73 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.8 tpt -21.05 118.42 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 117.291 2.33 . . . . 0.0 117.291 -168.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.467 HD23 ' NE2' ' A' ' 123' ' ' GLN . 3.2 mm? -112.09 105.9 14.39 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.816 1.246 . . . . 0.0 108.127 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.414 ' HB ' ' CH2' ' A' ' 79' ' ' TRP . 24.2 mt -93.73 130.43 42.71 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -175.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -110.08 -26.36 9.73 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.994 176.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.426 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 14.6 t70 -136.96 167.25 21.85 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.291 -173.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -37.55 75.02 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.162 0.985 . . . . 0.0 108.556 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 6.6 pt-20 -60.3 -27.29 67.19 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-O 121.197 0.522 . . . . 0.0 110.688 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.426 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 1.6 mt-10 -63.54 -54.62 33.26 Favored 'General case' 0 N--CA 1.422 -1.842 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.644 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 51.2 mt -68.44 -27.73 66.44 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.585 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 16.5 ptt180 -66.02 -34.81 78.95 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.564 -0.854 . . . . 0.0 108.901 177.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -72.44 -33.69 67.25 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 177.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.659 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -61.11 -49.46 77.21 Favored 'General case' 0 CA--C 1.48 -1.717 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 54.2 mt -56.18 -34.51 66.28 Favored 'General case' 0 C--N 1.314 -0.951 0 O-C-N 123.563 0.539 . . . . 0.0 112.092 -178.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.69 -44.58 85.75 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.86 0.362 . . . . 0.0 110.66 175.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 35.1 p -76.6 -27.55 55.81 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.019 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 53' ' ' LEU . 42.9 mm -66.79 -55.77 16.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.6 tptm 66.05 -63.23 0.24 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.855 1.262 . . . . 0.0 113.492 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -65.52 -39.93 92.37 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 122.69 0.396 . . . . 0.0 111.583 -175.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.557 ' H ' HG22 ' A' ' 57' ' ' ILE . 94.6 mttt 70.99 -47.3 0.65 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 173.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -67.3 -1.0 3.98 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 115.359 1.615 . . . . 0.0 115.359 -170.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.592 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 61.7 m-80 -82.04 -160.98 0.4 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 18.9 m -142.63 114.03 7.85 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.592 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 2.7 m-85 -121.61 118.52 29.41 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 117.636 0.198 . . . . 0.0 110.696 -175.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . 0.4 ' CH2' ' HB2' ' A' ' 112' ' ' GLU . 74.9 m95 -62.33 142.91 57.54 Favored 'General case' 0 C--N 1.312 -1.048 0 C-N-CA 123.239 0.616 . . . . 0.0 112.018 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.15 176.28 4.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 168.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.585 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.15 47.06 2.55 Favored Glycine 0 C--O 1.217 -0.92 0 CA-C-N 118.71 0.686 . . . . 0.0 114.309 -174.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.9 mt -112.13 118.56 35.69 Favored 'General case' 0 CA--C 1.494 -1.184 0 C-N-CA 123.818 0.847 . . . . 0.0 111.209 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -127.39 136.08 51.36 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.08 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -90.46 112.7 24.43 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 177.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.4 p . . . . . 0 C--N 1.298 -1.667 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.04 -175.184 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 20.1 m120 . . . . . 0 CA--C 1.489 -1.4 0 CA-C-O 120.996 0.427 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -94.01 107.05 19.0 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 171.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -105.28 145.98 29.96 Favored 'General case' 0 C--N 1.275 -2.64 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.807 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.585 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 47.8 m95 -87.25 165.02 15.98 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 176.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 47.0 pt -67.19 -17.83 23.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.515 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 32.7 p-10 -85.9 -9.59 56.68 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.171 0.51 . . . . 0.0 109.742 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.75 8.23 55.95 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.649 -0.705 . . . . 0.0 114.234 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.2 t -85.37 174.8 9.29 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 117.537 0.668 . . . . 0.0 109.911 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 88.0 m -101.18 140.68 35.14 Favored 'General case' 0 N--CA 1.42 -1.944 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.615 HD11 HD12 ' A' ' 92' ' ' ILE . 40.8 tp -53.92 132.56 42.21 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 178.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -92.47 81.86 4.87 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 170.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.4 p -71.74 -11.99 61.09 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.361 0.601 . . . . 0.0 111.19 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -77.34 -1.45 30.0 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.664 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 33.7 m -80.7 -47.69 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.446 174.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.408 ' HB2' HG23 ' A' ' 109' ' ' VAL . 95.5 mt -154.86 177.79 10.89 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.528 0.731 . . . . 0.0 109.147 -175.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -67.52 117.05 8.94 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -175.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.615 HD12 HD11 ' A' ' 85' ' ' LEU . 8.8 mt -149.86 114.57 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 172.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.7 m -69.88 128.66 37.15 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -81.45 -30.69 35.95 Favored Glycine 0 N--CA 1.418 -2.503 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -174.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -112.7 117.37 32.04 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.5 t -142.73 -19.89 0.67 Allowed 'General case' 0 C--N 1.289 -2.025 0 C-N-CA 119.041 -1.064 . . . . 0.0 111.199 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.2 mm-40 49.86 64.77 1.64 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.732 0.777 . . . . 0.0 112.765 -178.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -141.97 167.3 22.46 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.857 -174.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -90.54 29.14 1.34 Allowed 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 126.905 2.082 . . . . 0.0 107.48 175.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . 0.428 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 21.7 t -91.43 151.24 20.89 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 113.738 -1.574 . . . . 0.0 113.51 -171.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 66.8 m -130.87 151.63 51.08 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 174.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -92.76 149.51 21.25 Favored 'General case' 0 C--O 1.251 1.139 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -173.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.1 148.15 36.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.396 1.078 . . . . 0.0 110.328 -178.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.433 HD11 HD22 ' A' ' 50' ' ' LEU . 12.1 mm -77.07 125.61 37.02 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 C-N-CA 124.348 1.059 . . . . 0.0 108.414 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 8.8 t -149.85 95.34 2.3 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.444 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . 105.51 -143.19 15.65 Favored Glycine 0 C--N 1.296 -1.657 0 N-CA-C 109.083 -1.607 . . . . 0.0 109.083 -178.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -99.03 15.03 27.12 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -128.19 171.3 12.07 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.767 -173.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.408 HG23 ' HB2' ' A' ' 90' ' ' LEU . 10.5 t -104.21 142.46 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.654 0 N-CA-C 105.615 -1.995 . . . . 0.0 105.615 173.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.3 p -131.88 175.73 8.96 Favored 'General case' 0 C--N 1.278 -2.508 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 178.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . 0.428 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 19.4 p90 -138.9 139.04 37.93 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 119.229 0.922 . . . . 0.0 112.743 177.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . 0.4 ' HB2' ' CH2' ' A' ' 65' ' ' TRP . 16.8 mm-40 -125.24 168.5 13.38 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 -177.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.0 m -66.9 136.2 55.01 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 174.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 33.8 m -57.62 -16.88 11.71 Favored 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -173.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -95.41 7.95 44.7 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 123.683 0.793 . . . . 0.0 110.491 -173.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 51.1 p -90.67 140.06 30.13 Favored 'General case' 0 N--CA 1.427 -1.576 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.893 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -75.93 106.5 7.55 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.449 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -141.25 172.22 12.98 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 124.077 0.951 . . . . 0.0 108.684 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.762 ' HB3' ' O ' ' A' ' 21' ' ' SER . 4.7 mpt_? -83.3 -179.68 7.45 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 15.3 p90 -154.56 161.95 41.38 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 118.092 -1.443 . . . . 0.0 112.375 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 82.0 mt -119.83 122.25 68.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.415 0.626 . . . . 0.0 110.282 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 79.4 m -100.46 148.81 24.34 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.955 177.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.547 ' O ' ' HB1' ' A' ' 39' ' ' ALA . 5.4 pt20 -125.98 139.05 53.75 Favored 'General case' 0 N--CA 1.418 -2.028 0 N-CA-C 106.733 -1.581 . . . . 0.0 106.733 172.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -109.51 109.04 19.73 Favored 'General case' 0 C--N 1.259 -3.343 0 N-CA-C 103.699 -2.704 . . . . 0.0 103.699 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . 0.583 ' HA ' ' HG3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -63.72 116.44 5.72 Favored 'General case' 0 N--CA 1.424 -1.747 0 CA-C-O 122.17 0.986 . . . . 0.0 109.406 -176.98 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.698 HD13 ' SG ' ' A' ' 17' ' ' CYS . 12.4 tp . . . . . 0 N--CA 1.415 -2.178 0 CA-C-N 113.923 -1.49 . . . . 0.0 108.188 -170.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.417 HD13 ' HG ' ' A' ' 126' ' ' LEU . 3.9 mp . . . . . 0 N--CA 1.446 -0.638 0 N-CA-C 105.53 -2.026 . . . . 0.0 105.53 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -115.74 139.34 50.25 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 119.764 1.165 . . . . 0.0 112.25 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.5 m -101.4 157.06 34.39 Favored Pre-proline 0 C--N 1.303 -1.449 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.904 -177.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -64.98 164.18 25.78 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 121.713 1.609 . . . . 0.0 111.667 175.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -49.66 -44.57 47.82 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -176.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -80.83 15.43 1.78 Allowed 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -125.85 153.77 43.64 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.468 -0.77 . . . . 0.0 112.712 -172.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -94.83 -176.69 3.94 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 169.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 28.5 p -148.22 140.99 24.63 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 120.248 -0.581 . . . . 0.0 111.605 -179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -148.96 108.31 3.95 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 176.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 70.29 -85.35 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 125.366 1.466 . . . . 0.0 111.524 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -138.52 27.65 2.5 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.789 -174.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -145.57 157.23 44.01 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 176.404 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.644 ' SG ' HD13 ' A' ' 126' ' ' LEU . 7.6 m -112.69 140.79 47.17 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -116.63 145.77 43.17 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 118.801 0.728 . . . . 0.0 111.44 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -137.52 106.57 5.99 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.5 t -90.05 101.59 12.39 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.793 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.709 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 5.5 m -78.13 111.17 13.77 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.498 HE22 ' ND2' ' A' ' 62' ' ' ASN . 13.2 mm100 -79.01 14.73 1.3 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.77 0.828 . . . . 0.0 113.027 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.583 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 15.6 m -111.65 156.11 12.84 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 m -102.54 141.9 34.6 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -171.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -152.39 169.73 21.83 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 128.084 2.554 . . . . 0.0 106.842 -179.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 38.2 p -80.45 169.88 17.11 Favored 'General case' 0 C--O 1.253 1.278 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 169.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . 0.473 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 92.9 t90 -57.42 -49.04 77.49 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.743 0.306 . . . . 0.0 111.314 -176.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.05 -35.14 79.21 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.444 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -61.73 -47.77 83.74 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 120.519 0.199 . . . . 0.0 110.715 176.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.4 -35.87 92.63 Favored Glycine 0 CA--C 1.504 -0.631 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.252 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.99 -50.94 72.19 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 96.7 t -64.14 -32.99 59.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.504 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.19 -36.69 84.48 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.945 175.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 60.5 m -68.04 -39.78 83.01 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.43 -33.16 69.39 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 121.162 0.505 . . . . 0.0 109.842 176.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -60.03 -28.3 66.1 Favored Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 114.914 -1.039 . . . . 0.0 113.517 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -99.37 5.8 46.28 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 117.346 0.573 . . . . 0.0 110.302 177.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.5 49.94 41.02 Favored Glycine 0 N--CA 1.44 -1.046 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -174.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.28 177.38 9.05 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -118.88 165.59 13.87 Favored 'General case' 0 C--N 1.29 -2.014 0 C-N-CA 122.623 0.369 . . . . 0.0 110.587 -178.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.7 tp -77.54 132.02 38.15 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 18.1 tpt -30.38 121.93 0.19 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.449 HD12 ' HB3' ' A' ' 79' ' ' TRP . 2.6 mm? -114.39 98.64 7.04 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.502 HD13 HD21 ' A' ' 50' ' ' LEU . 40.8 mt -79.04 123.33 35.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -177.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 71.9 mm-40 -100.36 -20.63 15.75 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 120.055 -0.658 . . . . 0.0 112.45 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.512 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 21.3 t70 -159.72 169.69 23.14 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -174.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -73.34 -21.32 60.57 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 117.942 0.337 . . . . 0.0 110.781 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.471 ' HB2' ' OD2' ' A' ' 46' ' ' ASP . 0.5 OUTLIER -57.85 -34.41 69.7 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 123.847 0.859 . . . . 0.0 109.109 175.365 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.512 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 3.5 mm-40 -63.16 -55.04 28.54 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.296 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.636 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 79.6 mt -65.8 -24.81 67.0 Favored 'General case' 0 CA--C 1.496 -1.126 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -63.32 -44.93 93.53 Favored 'General case' 0 N--CA 1.402 -2.835 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -73.0 -25.28 60.92 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.654 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.674 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -63.52 -51.39 65.71 Favored 'General case' 0 C--O 1.184 -2.377 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 39.4 mt -51.96 -40.51 60.97 Favored 'General case' 0 C--N 1.311 -1.077 0 O-C-N 123.882 0.739 . . . . 0.0 111.562 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.34 -40.1 95.2 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.092 176.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.3 p -85.61 -9.69 56.93 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.468 0.651 . . . . 0.0 111.793 -179.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.8 mm -83.54 -52.4 13.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.083 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? 68.24 -69.86 0.14 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.209 1.004 . . . . 0.0 112.732 -178.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -59.12 -59.92 4.7 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 123.049 0.539 . . . . 0.0 111.895 -175.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.437 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 45.9 mtmt 75.03 -10.83 1.15 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.81 1.244 . . . . 0.0 112.772 -177.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -77.54 -21.95 51.83 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.682 0.277 . . . . 0.0 111.708 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 30.2 m-80 -78.84 -169.62 1.84 Allowed 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 15.9 m -140.96 122.97 15.53 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.592 -1.632 . . . . 0.0 106.592 178.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.8 m-85 -124.5 120.21 31.36 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -174.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -63.57 137.75 58.24 Favored 'General case' 0 C--N 1.311 -1.107 0 O-C-N 123.64 0.587 . . . . 0.0 111.451 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.67 175.13 2.86 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 168.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.584 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.53 44.55 2.25 Favored Glycine 0 C--O 1.216 -0.995 0 CA-C-N 118.792 0.724 . . . . 0.0 114.277 -174.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . 0.478 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 14.9 mt -113.51 123.81 50.9 Favored 'General case' 0 CA--C 1.486 -1.498 0 C-N-CA 124.154 0.981 . . . . 0.0 111.534 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -133.09 144.66 50.13 Favored 'General case' 0 C--N 1.295 -1.786 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.037 171.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 82.6 t80 -85.15 128.86 34.83 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 177.395 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.5 p . . . . . 0 C--N 1.278 -2.52 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -173.581 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.2 m120 . . . . . 0 N--CA 1.431 -1.407 0 CA-C-O 121.137 0.494 . . . . 0.0 110.442 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -103.29 118.47 36.84 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -125.58 157.29 37.52 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.509 177.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.584 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.0 m95 -95.62 165.76 12.17 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.02 -178.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 pt -67.11 -17.03 22.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.464 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 26.7 p-10 -86.26 -15.98 39.05 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.11 8.49 36.09 Favored Glycine 0 C--N 1.317 -0.523 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.665 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.7 m -80.0 162.39 24.91 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 122.617 0.367 . . . . 0.0 111.304 175.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 27.1 m -99.93 140.57 33.96 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.465 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 48.9 tp -68.21 133.21 48.49 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -89.26 91.07 8.62 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 167.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.2 m -70.99 -7.99 50.1 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.599 -177.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -77.75 -4.46 46.45 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.6 m -75.11 -52.95 17.4 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 118.646 -1.221 . . . . 0.0 110.939 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.5 mt -144.29 -178.44 5.97 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -176.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.411 ' HB2' ' HE3' ' A' ' 91' ' ' LYS . 18.8 ptmt -69.41 111.53 5.35 Favored 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -177.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.425 HD12 HD21 ' A' ' 85' ' ' LEU . 9.4 mt -146.67 120.18 2.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.239 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 173.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 95' ' ' ASP . 8.0 m -101.42 138.22 38.71 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 120.631 0.253 . . . . 0.0 110.6 -173.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -95.18 -15.29 45.21 Favored Glycine 0 N--CA 1.432 -1.624 0 N-CA-C 109.864 -1.294 . . . . 0.0 109.864 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . 0.419 ' H ' HG22 ' A' ' 93' ' ' THR . 4.2 m-20 -83.03 114.79 21.52 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 174.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.0 t -170.18 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 67.64 17.3 9.89 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -177.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -102.41 -171.33 1.94 Allowed 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -118.31 26.63 9.48 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 105.908 -1.886 . . . . 0.0 105.908 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 32.3 t -66.2 158.87 27.69 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 112.302 -2.226 . . . . 0.0 113.654 -172.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -135.1 154.56 51.63 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 124.831 1.253 . . . . 0.0 108.074 175.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -97.61 150.58 20.98 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -172.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -142.51 146.49 34.75 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 114.633 -1.167 . . . . 0.0 109.926 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.513 ' O ' ' HA ' ' A' ' 63' ' ' SER . 8.7 mm -77.44 126.71 38.13 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 C-N-CA 124.084 0.954 . . . . 0.0 108.585 177.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.2 t -154.36 96.47 1.92 Allowed 'General case' 0 N--CA 1.423 -1.781 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.437 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . 102.72 -144.18 16.03 Favored Glycine 0 N--CA 1.426 -1.969 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -102.85 22.36 13.94 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 174.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -129.91 169.69 14.88 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 114.171 -1.377 . . . . 0.0 107.81 -174.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 20.9 t -111.86 141.01 28.62 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.13 0 N-CA-C 104.864 -2.272 . . . . 0.0 104.864 172.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.1 p -128.89 171.69 12.05 Favored 'General case' 0 C--N 1.277 -2.58 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 18.8 p90 -149.07 139.85 22.76 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 118.739 0.7 . . . . 0.0 112.257 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -147.27 -176.88 5.4 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.335 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.5 m -72.93 125.48 27.67 Favored 'General case' 0 C--N 1.296 -1.739 0 O-C-N 123.378 0.424 . . . . 0.0 110.328 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 77.4 m -47.03 -23.27 0.44 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 126.803 2.041 . . . . 0.0 114.312 -177.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -83.03 -1.17 51.98 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.83 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.9 p -80.37 154.33 27.79 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 119.946 -0.701 . . . . 0.0 109.674 172.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -94.41 106.21 18.19 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -175.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -137.51 173.97 11.1 Favored 'General case' 0 C--O 1.204 -1.325 0 C-N-CA 123.179 0.592 . . . . 0.0 110.13 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.709 ' HB3' ' O ' ' A' ' 21' ' ' SER . 3.6 mpt_? -81.95 175.51 10.32 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 -177.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 18.9 p90 -149.77 165.81 31.33 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.642 1.11 . . . . 0.0 111.939 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.482 HD13 HD12 ' A' ' 53' ' ' LEU . 70.1 mt -124.61 124.88 69.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.356 0.598 . . . . 0.0 110.892 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 95.8 m -102.61 144.2 31.32 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.41 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.419 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 5.7 pt20 -127.48 139.55 52.73 Favored 'General case' 0 N--CA 1.42 -1.95 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 171.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.6 ttmm -110.64 118.25 35.7 Favored 'General case' 0 C--N 1.254 -3.567 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -69.79 118.34 12.52 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 175.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.644 HD13 ' SG ' ' A' ' 17' ' ' CYS . 12.8 tp . . . . . 0 C--N 1.295 -1.793 0 CA-C-N 114.157 -1.383 . . . . 0.0 109.715 -172.117 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.467 HD13 ' HB3' ' A' ' 126' ' ' LEU . 4.4 mp . . . . . 0 N--CA 1.441 -0.885 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -87.8 142.92 27.44 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 69.3 m -108.3 162.85 18.45 Favored Pre-proline 0 C--O 1.25 1.087 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.77 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.86 164.81 25.67 Favored 'Trans proline' 0 C--N 1.366 1.481 0 C-N-CA 122.493 2.129 . . . . 0.0 112.584 173.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -56.36 -21.51 25.15 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 125.481 1.512 . . . . 0.0 114.669 -175.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -85.17 -11.49 54.91 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 120.949 0.404 . . . . 0.0 110.411 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 37.4 m95 -113.34 158.93 19.96 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -165.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -99.38 175.96 5.68 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 169.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 33.7 p -139.9 132.39 28.6 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 118.8 0.727 . . . . 0.0 111.34 -179.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' HIS . . . . . 0.469 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 42.8 t-80 -149.57 124.09 9.71 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 122.188 -0.32 . . . . 0.0 111.041 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.51 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 3.0 mmp_? 66.71 -72.58 0.08 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.07 1.348 . . . . 0.0 113.22 175.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -158.98 21.37 0.2 Allowed 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 122.79 0.436 . . . . 0.0 110.511 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LYS . . . . . 0.526 ' HG2' ' NE2' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -145.01 148.1 33.36 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.518 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' CYS . . . . . 0.555 ' O ' ' HA ' ' A' ' 123' ' ' GLN . 8.9 m -95.87 146.58 24.45 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 175.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' PHE . . . . . 0.469 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 22.3 m-85 -117.9 143.12 46.61 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 118.624 0.647 . . . . 0.0 110.522 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -132.25 107.99 8.94 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 69.0 t -89.67 96.03 5.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.753 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 5.0 m -78.08 108.29 11.26 Favored 'General case' 0 N--CA 1.423 -1.786 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.41 HE22 ' ND2' ' A' ' 62' ' ' ASN . 14.8 mm100 -80.09 14.75 1.74 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.437 0.637 . . . . 0.0 112.201 178.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.51 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 6.0 m -103.13 150.06 6.92 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.881 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.4 m -106.01 141.55 37.2 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -172.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -154.16 174.39 14.8 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 127.906 2.483 . . . . 0.0 107.061 -176.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 114' ' ' CYS . 60.0 p -84.55 163.96 19.04 Favored 'General case' 0 C--O 1.255 1.366 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 169.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.9 t90 -53.19 -46.6 69.07 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.139 0.495 . . . . 0.0 111.852 -177.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -64.07 -37.26 86.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.928 -176.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -68.33 -45.44 72.9 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.659 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.92 -34.84 89.08 Favored Glycine 0 CA--C 1.506 -0.502 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.496 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 tt -56.34 -50.99 69.9 Favored 'General case' 0 C--O 1.25 1.092 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 175.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.36 -38.95 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.958 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.47 -40.05 77.71 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 64.6 m -66.26 -39.68 89.63 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.57 -29.26 70.45 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 120.992 0.425 . . . . 0.0 110.838 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.94 -16.59 78.31 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.247 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -92.47 -11.16 35.39 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 177.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.2 31.12 29.14 Favored Glycine 0 N--CA 1.444 -0.825 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 -171.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -129.81 176.98 7.59 Favored 'General case' 0 N--CA 1.42 -1.929 0 CA-C-N 114.755 -0.723 . . . . 0.0 110.096 -174.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' THR . . . . . 0.485 ' HB ' HD11 ' A' ' 80' ' ' ILE . 2.9 p -115.3 157.85 23.21 Favored 'General case' 0 C--N 1.282 -2.329 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.891 178.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.9 tp -66.47 140.68 58.03 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 173.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' MET . . . . . 0.431 ' HE3' ' HA ' ' A' ' 44' ' ' ILE . 16.3 tpt -39.31 120.75 1.07 Allowed 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -171.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.1 tp -121.04 90.52 3.34 Favored 'General case' 0 N--CA 1.434 -1.265 0 N-CA-C 106.427 -1.694 . . . . 0.0 106.427 -175.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ILE . . . . . 0.482 HD13 HD11 ' A' ' 50' ' ' LEU . 44.4 mt -67.61 122.74 19.34 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.019 -171.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -92.9 -21.85 19.59 Favored 'General case' 0 CA--C 1.552 1.058 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.984 -176.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ASP . . . . . 0.58 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 28.3 t70 -173.08 177.64 2.69 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -171.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -78.65 -31.06 46.67 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.576 -0.702 . . . . 0.0 111.274 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.415 ' HB2' ' OD2' ' A' ' 46' ' ' ASP . 0.7 OUTLIER -58.37 -30.23 66.62 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 124.052 0.941 . . . . 0.0 108.59 176.291 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLU . . . . . 0.58 ' HB2' ' O ' ' A' ' 46' ' ' ASP . 4.3 mm-40 -61.24 -56.27 22.52 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.429 174.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.603 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 79.5 mt -69.58 -28.47 66.0 Favored 'General case' 0 CA--C 1.48 -1.716 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -175.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.4 ptt180 -69.97 -34.19 73.05 Favored 'General case' 0 N--CA 1.421 -1.905 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.147 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -73.77 -28.28 61.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 175.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.65 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.0 mm? -61.47 -49.36 77.09 Favored 'General case' 0 C--O 1.182 -2.468 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 173.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 37.9 mt -55.35 -35.4 65.18 Favored 'General case' 0 C--N 1.313 -0.996 0 O-C-N 123.236 0.335 . . . . 0.0 111.351 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -68.12 -42.59 79.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.073 176.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.2 p -79.51 -24.52 42.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -178.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 53' ' ' LEU . 36.4 mm -65.84 -51.36 62.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 174.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 49.6 tptt 72.6 -65.67 0.34 Allowed 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.06 0.944 . . . . 0.0 113.472 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -65.06 -55.32 19.55 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 118.633 0.652 . . . . 0.0 112.429 -176.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.555 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 44.5 mtmt 69.44 21.34 6.9 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.429 0.692 . . . . 0.0 110.369 -177.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -120.17 19.7 12.17 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.272 0.558 . . . . 0.0 110.852 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASN . . . . . 0.538 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 41.9 m-80 -124.47 -153.8 0.58 Allowed 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' SER . . . . . 0.58 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 5.6 t -149.8 126.97 11.31 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 175.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' PHE . . . . . 0.538 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.1 m-85 -129.57 113.37 14.74 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -175.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -57.63 136.76 56.84 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 124.085 0.954 . . . . 0.0 112.29 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -120.68 176.71 3.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 170.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLY . . . . . 0.593 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -78.19 56.63 4.02 Favored Glycine 0 C--O 1.204 -1.775 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.814 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.7 mt -125.03 121.07 33.3 Favored 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 122.998 0.519 . . . . 0.0 111.718 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 30.0 ptt180 -128.3 135.42 49.59 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.084 176.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -81.33 113.5 19.48 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.4 p . . . . . 0 C--N 1.3 -1.583 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.848 -174.002 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 17.2 m120 . . . . . 0 N--CA 1.431 -1.387 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -100.82 122.42 43.4 Favored 'General case' 0 C--N 1.288 -2.074 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -116.82 147.2 42.33 Favored 'General case' 0 C--N 1.291 -1.964 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.183 178.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' TRP . . . . . 0.593 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 16.1 m95 -91.0 178.14 6.09 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 123.951 0.782 . . . . 0.0 109.504 -177.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.485 HD11 ' HB ' ' A' ' 40' ' ' THR . 48.6 pt -73.06 -12.46 15.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.028 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ASN . . . . . 0.478 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 31.5 p-10 -95.55 -0.91 51.52 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.802 0.81 . . . . 0.0 109.021 178.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.1 5.58 76.51 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 114.5 -1.227 . . . . 0.0 113.563 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.9 t -81.83 169.4 16.92 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -178.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.2 m -100.04 142.9 30.9 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LEU . . . . . 0.544 HD11 HD12 ' A' ' 92' ' ' ILE . 36.9 tp -54.57 138.87 39.88 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 124.63 1.172 . . . . 0.0 113.233 176.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ASN . . . . . 0.468 ' OD1' HG13 ' A' ' 89' ' ' VAL . 25.9 t-20 -93.57 86.52 5.22 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 170.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 p -73.08 3.83 5.05 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -77.57 -21.78 51.97 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.463 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.468 HG13 ' OD1' ' A' ' 86' ' ' ASN . 32.9 m -78.56 -55.24 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 C-N-CA 120.156 -0.617 . . . . 0.0 112.367 -178.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' LEU . . . . . 0.426 HD12 HD13 ' A' ' 50' ' ' LEU . 94.4 mt -140.29 170.37 15.95 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -175.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.415 ' O ' HG12 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -72.97 123.19 23.0 Favored 'General case' 0 CA--C 1.5 -0.963 0 O-C-N 123.876 0.735 . . . . 0.0 112.632 -175.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ILE . . . . . 0.544 HD12 HD11 ' A' ' 85' ' ' LEU . 2.4 mt -152.32 99.47 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 N-CA-C 104.733 -2.321 . . . . 0.0 104.733 174.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 5.3 m -66.8 136.69 55.84 Favored 'General case' 0 C--N 1.285 -2.21 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.553 -173.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -102.0 26.34 24.68 Favored Glycine 0 CA--C 1.479 -2.203 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -175.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -152.44 130.63 11.96 Favored 'General case' 0 N--CA 1.409 -2.515 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 174.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.4 t -169.93 -31.62 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.596 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 65.81 28.54 10.84 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.448 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -105.57 178.63 4.51 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.877 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -96.81 27.75 3.8 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.0 p -63.31 150.35 43.49 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 113.004 -1.907 . . . . 0.0 115.797 -171.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -134.03 147.53 50.97 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 113.444 -1.707 . . . . 0.0 106.688 173.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.48 151.56 19.27 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -172.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -146.71 147.37 30.9 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.849 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' ILE . . . . . 0.58 ' O ' ' HA ' ' A' ' 63' ' ' SER . 11.5 mm -76.95 131.06 35.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 107.397 -1.335 . . . . 0.0 107.397 177.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 27.9 t -106.68 -71.23 0.76 Allowed 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 175.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' GLY . . . . . 0.555 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . -124.98 -102.22 1.39 Allowed Glycine 0 N--CA 1.413 -2.893 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 178.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -98.64 2.47 47.29 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -125.51 162.74 24.22 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.034 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' VAL . . . . . 0.427 ' HB ' HG12 ' A' ' 92' ' ' ILE . 3.8 t -99.37 136.82 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.419 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 174.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.3 p -125.39 166.47 16.51 Favored 'General case' 0 C--N 1.269 -2.917 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.8 p90 -138.85 134.15 32.94 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 118.927 0.785 . . . . 0.0 112.848 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -132.24 179.58 6.03 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.491 -1.231 . . . . 0.0 108.406 -176.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.4 m -78.31 129.22 34.77 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 174.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' CYS . . . . . 0.404 ' O ' ' HB ' ' A' ' 26' ' ' THR . 76.6 m -48.21 -18.94 0.24 Allowed 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 126.591 1.956 . . . . 0.0 115.038 -176.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -86.37 -3.99 59.09 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 123.525 0.73 . . . . 0.0 110.559 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.0 p -77.43 149.59 35.1 Favored 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 119.965 -0.694 . . . . 0.0 111.069 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -86.39 93.8 9.21 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.989 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -128.35 174.45 9.3 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 114.804 -1.089 . . . . 0.0 108.523 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ARG . . . . . 0.753 ' HB3' ' O ' ' A' ' 21' ' ' SER . 2.5 mpt_? -93.37 -174.5 3.53 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 -177.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' TRP . . . . . 0.425 ' CH2' HG23 ' A' ' 23' ' ' VAL . 28.8 p90 -152.21 167.56 28.19 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.864 1.211 . . . . 0.0 111.95 -179.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 69.9 mt -125.59 129.85 72.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.451 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 75.0 m -110.03 150.98 27.75 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' GLN . . . . . 0.555 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.3 pt20 -128.25 140.64 51.78 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 171.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -117.27 115.16 24.74 Favored 'General case' 0 C--N 1.277 -2.556 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -74.95 120.69 20.82 Favored 'General case' 0 C--N 1.286 -2.156 0 CA-C-O 121.362 0.601 . . . . 0.0 111.803 -174.24 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' LEU . . . . . 0.467 ' HB3' HD13 ' A' ' 4' ' ' LEU . 2.8 mm? . . . . . 0 CA--C 1.504 -0.814 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.075 179.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.559 ' HB2' ' OD1' ' A' ' 15' ' ' ASP . 14.1 m . . . . . 0 N--CA 1.441 -0.899 0 N-CA-C 108.678 -0.86 . . . . 0.0 108.678 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -102.97 7.69 39.1 Favored 'General case' 0 C--O 1.242 0.699 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -173.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.41 ' HE3' ' CB ' ' A' ' 12' ' ' SER 0.251 6.3 tmtt? 69.25 139.31 0.04 OUTLIER 'General case' 0 CA--C 1.544 0.725 0 N-CA-C 114.631 1.345 . . . . 0.0 114.631 179.626 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.526 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 6.0 mp -97.3 175.85 6.12 Favored 'General case' 0 C--N 1.314 -0.962 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 176.647 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -79.49 143.38 34.96 Favored 'General case' 0 C--N 1.29 -1.981 0 N-CA-C 113.114 0.783 . . . . 0.0 113.114 -174.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.671 ' SG ' ' HD2' ' A' ' 7' ' ' PRO . 49.0 t -137.37 156.2 75.27 Favored Pre-proline 0 C--N 1.306 -1.293 0 N-CA-C 107.226 -1.398 . . . . 0.0 107.226 -179.081 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.671 ' HD2' ' SG ' ' A' ' 6' ' ' CYS . 81.7 Cg_exo -48.78 153.22 3.79 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 122.843 2.362 . . . . 0.0 112.814 176.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -59.95 -29.37 68.37 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 -171.077 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -78.43 -10.84 59.86 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-O 121.295 0.569 . . . . 0.0 111.226 -175.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.476 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 26.9 m95 -95.63 117.03 29.71 Favored 'General case' 0 C--N 1.285 -2.236 0 CA-C-N 115.663 -0.699 . . . . 0.0 110.041 -173.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.421 ' H ' HD22 ' A' ' 11' ' ' LEU . 1.3 mm? -72.72 122.04 20.83 Favored 'General case' 0 CA--C 1.497 -1.066 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -176.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.41 ' CB ' ' HE3' ' A' ' 3' ' ' LYS . 11.0 p -92.7 128.52 38.58 Favored 'General case' 0 N--CA 1.41 -2.428 0 CA-C-O 122.355 1.074 . . . . 0.0 113.556 -174.014 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 25.5 t60 -138.41 154.78 48.9 Favored 'General case' 0 C--O 1.2 -1.531 0 C-N-CA 126.973 2.109 . . . . 0.0 105.839 -177.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 81.8 mtp180 -11.89 83.98 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.998 0 C-N-CA 125.78 1.632 . . . . 0.0 114.586 175.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.559 ' OD1' ' HB2' ' A' ' 1' ' ' SER . 18.9 m-20 60.74 23.53 13.42 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.801 1.641 . . . . 0.0 114.617 173.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.593 ' HE2' ' OE1' ' A' ' 49' ' ' GLU . 13.0 mtpp -148.86 142.58 25.56 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 179.822 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.859 ' SG ' ' HB3' ' A' ' 124' ' ' LYS . 19.4 p -123.9 139.28 54.11 Favored 'General case' 0 C--N 1.287 -2.116 0 O-C-N 121.511 -0.743 . . . . 0.0 109.807 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.448 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 17.5 m-85 -116.87 140.51 49.37 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 112.714 0.635 . . . . 0.0 112.714 -171.261 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -115.56 106.64 14.16 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 173.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.1 t -87.42 92.47 3.81 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.18 0 N-CA-C 107.759 -1.2 . . . . 0.0 107.759 178.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.77 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.1 m -77.26 114.56 16.2 Favored 'General case' 0 N--CA 1.423 -1.804 0 CA-C-N 114.992 -1.004 . . . . 0.0 109.354 -176.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.554 ' C ' ' HG2' ' A' ' 119' ' ' ARG . 9.2 mm100 -83.86 13.92 4.46 Favored 'General case' 0 N--CA 1.484 1.27 0 C-N-CA 123.755 0.822 . . . . 0.0 112.663 179.428 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.497 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.8 m -109.63 150.09 12.43 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.02 0 N-CA-C 107.637 -1.245 . . . . 0.0 107.637 178.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 46.0 m -98.24 152.8 19.01 Favored 'General case' 0 C--N 1.291 -1.938 0 N-CA-C 114.239 1.199 . . . . 0.0 114.239 -173.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 52.9 m-20 -154.43 -176.92 6.12 Favored 'General case' 0 C--N 1.314 -0.937 0 C-N-CA 127.506 2.322 . . . . 0.0 106.687 178.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 61.3 p -91.81 168.34 11.52 Favored 'General case' 0 C--N 1.301 -1.515 0 N-CA-C 107.068 -1.456 . . . . 0.0 107.068 168.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.42 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 92.0 t90 -58.35 -53.83 53.87 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.593 0.633 . . . . 0.0 112.289 -175.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.492 ' O ' HG23 ' A' ' 32' ' ' VAL . 42.9 mt-10 -64.93 -31.93 73.41 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.307 0.575 . . . . 0.0 110.416 -177.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 41.9 tt0 -71.45 -42.15 68.56 Favored 'General case' 0 C--N 1.304 -1.392 0 CA-C-N 115.124 -0.943 . . . . 0.0 110.594 -178.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -65.57 -33.88 87.51 Favored Glycine 0 CA--C 1.501 -0.843 0 N-CA-C 110.859 -0.896 . . . . 0.0 110.859 175.382 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.5 tt -59.91 -46.86 88.01 Favored 'General case' 0 CA--C 1.546 0.808 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 176.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 28' ' ' GLU . 90.1 t -61.87 -36.68 75.23 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 CA-C-N 115.959 -0.564 . . . . 0.0 110.274 179.064 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -61.26 -36.76 80.9 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 116.009 -0.542 . . . . 0.0 111.845 175.752 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 52.0 m -71.51 -40.07 70.38 Favored 'General case' 0 C--O 1.247 0.93 0 N-CA-C 109.459 -0.571 . . . . 0.0 109.459 176.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 44.3 m-20 -55.98 -39.7 72.2 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 177.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -56.17 -34.41 62.54 Favored Glycine 0 CA--C 1.523 0.558 0 CA-C-N 114.943 -1.026 . . . . 0.0 114.434 -179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.8 mptp? -89.76 -5.3 57.09 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 117.51 0.655 . . . . 0.0 111.507 179.226 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.06 51.91 5.98 Favored Glycine 0 N--CA 1.442 -0.931 0 N-CA-C 107.753 -2.139 . . . . 0.0 107.753 -171.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.01 178.04 8.5 Favored 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 -176.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 3.2 p -123.14 158.48 30.62 Favored 'General case' 0 C--N 1.281 -2.409 0 C-N-CA 122.765 0.426 . . . . 0.0 110.936 -177.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 26.1 tp -76.15 130.48 38.33 Favored 'General case' 0 C--N 1.308 -1.23 0 N-CA-C 105.524 -2.028 . . . . 0.0 105.524 174.507 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.2 tpt -30.03 120.53 0.17 Allowed 'General case' 0 N--CA 1.498 1.927 0 N-CA-C 117.264 2.32 . . . . 0.0 117.264 -169.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.444 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 3.1 mm? -109.1 110.95 22.32 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 124.704 1.201 . . . . 0.0 108.007 177.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.515 HD13 HD21 ' A' ' 50' ' ' LEU . 37.8 mt -98.68 132.84 43.1 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.565 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -175.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.488 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 56.0 tp60 -105.84 -44.27 4.67 Favored 'General case' 0 C--N 1.312 -1.036 0 CA-C-O 120.868 0.365 . . . . 0.0 111.464 179.422 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.9 t70 -137.57 178.13 7.34 Favored 'General case' 0 C--N 1.316 -0.85 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 -172.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.7 tt0 -81.04 -19.42 43.88 Favored 'General case' 0 N--CA 1.435 -1.199 0 O-C-N 122.049 -0.407 . . . . 0.0 110.362 -178.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.509 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 51.9 mt-10 -57.91 -33.23 68.54 Favored 'General case' 0 N--CA 1.479 0.977 0 CA-C-O 121.699 0.762 . . . . 0.0 109.788 173.495 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.593 ' OE1' ' HE2' ' A' ' 16' ' ' LYS . 10.2 mm-40 -64.89 -55.36 19.84 Favored 'General case' 0 N--CA 1.43 -1.459 0 CA-C-N 114.671 -1.15 . . . . 0.0 107.995 179.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.515 HD21 HD13 ' A' ' 44' ' ' ILE . 63.4 mt -68.96 -25.15 64.4 Favored 'General case' 0 CA--C 1.496 -1.13 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -176.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.509 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 34.7 ptt180 -68.93 -33.73 74.21 Favored 'General case' 0 N--CA 1.43 -1.434 0 C-N-CA 119.957 -0.697 . . . . 0.0 109.363 178.301 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 82.7 t80 -73.72 -28.21 61.59 Favored 'General case' 0 N--CA 1.446 -0.631 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 174.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.669 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.4 mm? -63.75 -48.83 75.4 Favored 'General case' 0 C--O 1.176 -2.805 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 175.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.514 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 43.7 mt -54.76 -34.11 62.15 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.173 0.435 . . . . 0.0 112.173 178.844 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -67.35 -46.74 72.51 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.953 0.406 . . . . 0.0 111.444 172.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.8 p -81.17 -20.88 40.27 Favored 'General case' 0 C--N 1.309 -1.158 0 N-CA-C 113.341 0.867 . . . . 0.0 113.341 -174.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.669 HG12 ' O ' ' A' ' 53' ' ' LEU . 16.6 mm -56.24 -45.97 81.27 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 C-N-CA 123.817 0.847 . . . . 0.0 111.031 178.322 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? 69.86 -63.69 0.38 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.024 0.929 . . . . 0.0 112.798 177.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -70.87 -56.34 6.5 Favored 'General case' 0 C--N 1.307 -1.265 0 N-CA-C 113.427 0.899 . . . . 0.0 113.427 -175.306 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.418 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 91.4 mttt 74.06 -38.57 0.4 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 124.175 0.99 . . . . 0.0 113.669 -176.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.6 m-85 -82.3 28.85 0.44 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-O 121.879 0.847 . . . . 0.0 111.707 -175.272 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.44 ' ND2' HE22 ' A' ' 22' ' ' GLN . 53.4 m-80 -132.6 -173.99 3.33 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 114.685 -1.143 . . . . 0.0 108.026 177.167 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.607 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 13.3 m -137.63 133.09 33.93 Favored 'General case' 0 C--N 1.304 -1.388 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 179.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.483 ' CE2' HD12 ' A' ' 57' ' ' ILE . 1.0 OUTLIER -131.47 118.62 20.44 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 109.515 -0.55 . . . . 0.0 109.515 -175.556 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 76.9 m95 -59.99 135.95 57.87 Favored 'General case' 0 C--N 1.311 -1.082 0 C-N-CA 123.357 0.663 . . . . 0.0 112.038 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.59 176.21 2.42 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.113 0 N-CA-C 106.6 -1.629 . . . . 0.0 106.6 169.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.558 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.28 40.44 1.73 Allowed Glycine 0 C--O 1.22 -0.763 0 CA-C-N 118.89 0.768 . . . . 0.0 114.59 -174.093 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.558 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 20.5 mt -101.93 115.51 30.7 Favored 'General case' 0 CA--C 1.488 -1.422 0 C-N-CA 123.191 0.596 . . . . 0.0 111.637 179.538 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 28.4 ptt180 -122.02 137.22 54.88 Favored 'General case' 0 C--N 1.289 -2.051 0 CA-C-N 114.835 -1.075 . . . . 0.0 109.104 177.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -91.11 113.69 26.02 Favored 'General case' 0 C--N 1.287 -2.137 0 N-CA-C 107.396 -1.335 . . . . 0.0 107.396 -179.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.451 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 22.7 p -94.83 116.88 29.27 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 112.658 0.614 . . . . 0.0 112.658 -174.129 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.412 HD23 ' H ' ' A' ' 75' ' ' MET . 50.5 mt -119.97 144.02 36.61 Favored Pre-proline 0 C--N 1.309 -1.16 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.168 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -85.7 126.76 9.86 Favored 'Cis proline' 0 N--CA 1.446 -1.312 0 C-N-CA 123.493 -1.461 . . . . 0.0 111.78 -0.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.451 ' HB3' ' O ' ' A' ' 71' ' ' THR . 13.4 t70 175.77 -42.87 0.01 OUTLIER 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 124.113 0.965 . . . . 0.0 109.155 -174.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.412 ' H ' HD23 ' A' ' 72' ' ' LEU . 45.4 mtm 71.49 11.83 6.55 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 114.508 1.299 . . . . 0.0 114.508 176.061 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -106.14 154.88 20.05 Favored 'General case' 0 C--N 1.307 -1.279 0 C-N-CA 119.981 -0.688 . . . . 0.0 110.052 172.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -88.92 125.72 35.07 Favored 'General case' 0 N--CA 1.422 -1.874 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.371 176.411 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -118.9 158.84 24.91 Favored 'General case' 0 C--N 1.286 -2.152 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.121 178.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.558 ' CZ3' ' HG ' ' A' ' 68' ' ' LEU . 62.4 m95 -96.19 176.32 6.12 Favored 'General case' 0 C--N 1.277 -2.572 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 177.185 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.4 pt -73.36 -23.34 19.68 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.333 0 CA-C-O 121.01 0.433 . . . . 0.0 111.362 -179.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.416 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 29.6 p-10 -83.3 -16.32 46.68 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 109.48 -0.563 . . . . 0.0 109.48 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.3 8.49 35.64 Favored Glycine 0 N--CA 1.446 -0.696 0 CA-C-N 115.435 -0.802 . . . . 0.0 113.081 175.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 34.8 m -75.65 170.52 16.01 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 112.473 0.545 . . . . 0.0 112.473 175.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 20.7 m -102.54 139.68 37.82 Favored 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.533 HD13 HD21 ' A' ' 68' ' ' LEU . 42.0 tp -62.98 142.36 58.39 Favored 'General case' 0 C--N 1.308 -1.204 0 N-CA-C 113.617 0.969 . . . . 0.0 113.617 176.741 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 53.4 t-20 -95.7 86.8 4.5 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 105.852 -1.907 . . . . 0.0 105.852 169.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.6 p -71.09 -8.23 52.02 Favored 'General case' 0 C--N 1.315 -0.929 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -176.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -77.94 -14.12 59.64 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -176.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 27.7 m -75.76 -49.66 25.72 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 119.946 -0.702 . . . . 0.0 112.828 -178.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 96.0 mt -147.69 -179.01 6.57 Favored 'General case' 0 CA--C 1.51 -0.593 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 -173.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 99.87 1.74 Allowed 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 114.423 1.268 . . . . 0.0 114.423 -177.041 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.48 HD12 HD11 ' A' ' 85' ' ' LEU . 8.0 mt -140.51 96.67 0.83 Allowed 'Isoleucine or valine' 0 C--N 1.291 -1.947 0 N-CA-C 106.616 -1.624 . . . . 0.0 106.616 172.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.3 m -62.24 124.67 21.48 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 116.099 -0.501 . . . . 0.0 109.884 -178.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -85.69 -41.49 7.24 Favored Glycine 0 N--CA 1.41 -3.059 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -177.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 13.2 p-10 -94.29 88.37 5.54 Favored 'General case' 0 N--CA 1.418 -2.062 0 CA-C-O 121.82 0.819 . . . . 0.0 110.971 178.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.8 t -126.39 -32.43 2.68 Favored 'General case' 0 C--N 1.314 -0.956 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.536 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 17.4 mt-10 60.83 36.99 18.91 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 123.303 0.641 . . . . 0.0 111.383 176.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 -116.99 177.82 4.57 Favored 'General case' 0 N--CA 1.472 0.636 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 179.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -81.58 27.69 0.43 Allowed 'General case' 0 N--CA 1.5 2.064 0 C-N-CA 126.167 1.787 . . . . 0.0 109.372 -179.136 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.411 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 13.9 m -72.85 142.62 47.97 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 116.38 1.993 . . . . 0.0 116.38 -170.033 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 61.6 m -133.06 146.28 51.54 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 103.944 -2.613 . . . . 0.0 103.944 166.075 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -99.81 153.14 19.37 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 113.736 1.013 . . . . 0.0 113.736 -172.193 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.29 148.43 36.33 Favored 'General case' 0 N--CA 1.44 -0.946 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.61 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.607 ' O ' ' HA ' ' A' ' 63' ' ' SER . 11.0 mm -78.13 128.4 38.26 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.483 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 175.02 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 2.1 t -140.42 90.17 2.34 Favored 'General case' 0 N--CA 1.408 -2.529 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 176.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.418 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . 89.0 -126.65 8.3 Favored Glycine 0 N--CA 1.429 -1.794 0 CA-C-N 114.637 -1.165 . . . . 0.0 110.25 -179.88 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -101.86 8.55 41.23 Favored 'General case' 0 C--N 1.301 -1.501 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 176.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -119.13 167.21 12.02 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 114.991 -1.004 . . . . 0.0 108.814 -175.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 14.2 t -115.75 134.24 59.63 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.013 0 N-CA-C 104.682 -2.34 . . . . 0.0 104.682 173.265 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 69.7 p -124.97 170.07 11.48 Favored 'General case' 0 C--N 1.267 -2.988 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 -178.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.411 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 25.4 p90 -148.46 142.04 25.45 Favored 'General case' 0 C--N 1.298 -1.666 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.421 -178.781 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -154.69 178.69 9.83 Favored 'General case' 0 C--N 1.299 -1.608 0 CA-C-N 115.661 -0.7 . . . . 0.0 109.815 -176.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.424 ' HB3' ' ND2' ' A' ' 115' ' ' ASN . 29.3 m -54.07 124.53 15.9 Favored 'General case' 0 N--CA 1.443 -0.817 0 O-C-N 124.132 0.895 . . . . 0.0 108.992 176.486 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 8.4 m -53.57 -22.88 9.27 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.491 1.117 . . . . 0.0 112.635 -174.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.424 ' ND2' ' HB3' ' A' ' 113' ' ' SER . 9.1 p30 -80.43 -2.06 44.15 Favored 'General case' 0 C--N 1.306 -1.294 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.09 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 24.9 p -74.47 136.58 42.28 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 119.236 0.925 . . . . 0.0 112.608 179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -62.79 101.42 0.26 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.328 177.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.531 ' OD1' ' HB2' ' A' ' 63' ' ' SER . 47.3 m-80 -142.58 158.98 43.1 Favored 'General case' 0 CA--C 1.485 -1.539 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.209 179.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.77 ' HB3' ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -76.57 178.68 6.49 Favored 'General case' 0 C--N 1.292 -1.925 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 179.093 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 18.4 p90 -152.36 167.14 29.65 Favored 'General case' 0 C--N 1.323 -0.583 0 C-N-CA 118.733 -1.187 . . . . 0.0 112.36 -174.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.507 HD13 HD12 ' A' ' 53' ' ' LEU . 82.6 mt -125.29 118.28 52.21 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.836 0 CA-C-O 121.625 0.726 . . . . 0.0 110.712 179.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 90.7 m -97.02 140.87 30.89 Favored 'General case' 0 C--N 1.287 -2.135 0 CA-C-N 115.009 -0.996 . . . . 0.0 108.758 175.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.451 ' O ' ' HG3' ' A' ' 123' ' ' GLN . 5.0 pt20 -120.12 137.86 53.91 Favored 'General case' 0 N--CA 1.415 -2.213 0 N-CA-C 107.044 -1.465 . . . . 0.0 107.044 173.553 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.859 ' HB3' ' SG ' ' A' ' 17' ' ' CYS . 22.8 ttmm -110.95 110.91 21.69 Favored 'General case' 0 C--N 1.258 -3.374 0 N-CA-C 104.585 -2.376 . . . . 0.0 104.585 171.113 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 15.9 tt0 -83.54 124.0 30.31 Favored 'General case' 0 N--CA 1.406 -2.63 0 C-N-CA 119.621 -0.832 . . . . 0.0 108.767 -175.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.526 ' HG ' ' H ' ' A' ' 4' ' ' LEU . 1.8 mm? -68.2 -21.12 64.88 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.068 -0.969 . . . . 0.0 110.255 -177.117 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' TYR . . . . . 0.466 ' HD1' ' HB3' ' A' ' 15' ' ' ASP . 32.6 m-85 -111.88 85.54 2.16 Favored 'General case' 0 C--N 1.305 -1.352 0 CA-C-N 115.385 -0.825 . . . . 0.0 110.125 173.219 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 8.9 p-80 -109.48 -10.05 14.9 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 115.197 -0.91 . . . . 0.0 109.93 176.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 27.0 mm-40 -99.06 17.62 19.32 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.081 -0.963 . . . . 0.0 109.783 177.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 2.6 m -61.14 -70.2 0.2 Allowed 'General case' 0 C--N 1.319 -0.759 0 C-N-CA 123.16 0.584 . . . . 0.0 111.116 -177.472 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 90.1 mt -130.55 105.52 7.9 Favored 'General case' 0 N--CA 1.436 -1.131 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.9 m -87.75 -40.88 13.72 Favored 'General case' 0 C--N 1.292 -1.897 0 N-CA-C 107.502 -1.295 . . . . 0.0 107.502 176.657 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 56.5 m-80 68.52 155.71 0.12 Allowed 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 114.198 -1.365 . . . . 0.0 112.947 177.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 50.6 m-85 65.94 163.28 0.16 Allowed 'General case' 0 C--O 1.242 0.687 0 C-N-CA 125.287 1.435 . . . . 0.0 113.541 175.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 22.3 t -115.55 23.14 5.48 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.273 0 N-CA-C 104.914 -2.254 . . . . 0.0 104.914 172.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 117.54 -82.28 0.33 Allowed Glycine 0 N--CA 1.422 -2.283 0 N-CA-C 108.315 -1.914 . . . . 0.0 108.315 -173.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -143.08 -55.25 0.41 Allowed 'General case' 0 C--N 1.3 -1.583 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 175.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 145.6 56.45 0.02 OUTLIER Glycine 0 N--CA 1.427 -1.934 0 N-CA-C 109.971 -1.251 . . . . 0.0 109.971 -179.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 75.8 t60 . . . . . 0 C--N 1.308 -1.198 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 -179.215 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 22.5 m . . . . . 0 C--O 1.245 0.855 0 CA-C-O 120.866 0.365 . . . . 0.0 111.024 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -95.92 91.4 5.99 Favored 'General case' 0 N--CA 1.443 -0.787 0 N-CA-C 109.629 -0.508 . . . . 0.0 109.629 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.464 ' HB3' ' O ' ' A' ' 14' ' ' ARG . 0.0 OUTLIER -78.32 165.82 23.41 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-O 121.322 0.582 . . . . 0.0 111.871 -178.398 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.447 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 4.7 mp -97.91 -160.51 0.81 Allowed 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 114.926 -1.034 . . . . 0.0 108.614 179.42 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -94.38 135.05 36.24 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 120.374 -0.53 . . . . 0.0 111.577 -176.557 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.494 ' HB3' HD11 ' A' ' 126' ' ' LEU . 8.8 p -128.58 166.41 24.76 Favored Pre-proline 0 C--N 1.296 -1.738 0 C-N-CA 124.089 0.956 . . . . 0.0 108.501 177.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_exo -61.42 156.91 43.66 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 121.641 1.561 . . . . 0.0 113.155 179.016 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.3 pt20 -42.64 -48.64 5.51 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 116.299 1.963 . . . . 0.0 116.299 -175.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 14.0 m-20 -83.76 7.15 18.68 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -172.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.521 ' HB3' ' HB3' ' A' ' 17' ' ' CYS . 60.1 m95 -104.4 121.45 43.42 Favored 'General case' 0 C--N 1.301 -1.534 0 CA-C-O 121.232 0.539 . . . . 0.0 110.711 -177.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.534 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 4.8 mp -75.92 106.51 7.54 Favored 'General case' 0 C--N 1.31 -1.132 0 C-N-CA 124.843 1.257 . . . . 0.0 111.063 -176.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.1 p -74.66 114.44 13.08 Favored 'General case' 0 C--N 1.276 -2.625 0 CA-C-N 115.165 -0.925 . . . . 0.0 112.794 -176.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -138.93 125.72 20.9 Favored 'General case' 0 C--N 1.322 -0.594 0 C-N-CA 123.999 0.919 . . . . 0.0 109.413 179.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.464 ' O ' ' HB3' ' A' ' 3' ' ' LYS . 72.3 mtt180 57.93 -88.61 0.02 OUTLIER 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 -178.623 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.57 ' HB2' ' CD1' ' A' ' 127' ' ' TYR . 10.0 p-10 -144.69 25.31 1.48 Allowed 'General case' 0 C--N 1.31 -1.136 0 CA-C-O 121.499 0.666 . . . . 0.0 110.112 -177.024 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.36 151.7 36.96 Favored 'General case' 0 CA--C 1.507 -0.697 0 N-CA-C 107.861 -1.163 . . . . 0.0 107.861 178.703 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.636 ' SG ' HD21 ' A' ' 126' ' ' LEU . 80.8 m -116.34 140.36 49.42 Favored 'General case' 0 C--N 1.275 -2.631 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.057 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 -110.82 141.67 43.86 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -172.206 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 46.8 t-80 -119.24 108.17 14.31 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 107.453 -1.314 . . . . 0.0 107.453 173.757 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 58.0 t -89.18 95.05 5.13 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.635 0 N-CA-C 108.232 -1.025 . . . . 0.0 108.232 178.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.69 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.8 m -77.97 115.19 17.52 Favored 'General case' 0 N--CA 1.417 -2.085 0 CA-C-N 115.328 -0.851 . . . . 0.0 108.725 -179.369 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.576 HE22 ' ND2' ' A' ' 62' ' ' ASN . 12.0 mm100 -87.82 13.75 10.08 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.956 0.902 . . . . 0.0 111.255 -178.424 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 9.8 m -107.65 156.48 8.12 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.988 0 N-CA-C 108.143 -1.058 . . . . 0.0 108.143 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 37.7 m -91.77 156.74 17.33 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 114.319 1.229 . . . . 0.0 114.319 -173.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 27.1 m-20 -170.88 170.75 6.28 Favored 'General case' 0 CA--C 1.502 -0.876 0 C-N-CA 127.414 2.286 . . . . 0.0 107.912 175.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 18.5 p -85.02 166.02 17.06 Favored 'General case' 0 C--N 1.297 -1.695 0 N-CA-C 108.297 -1.001 . . . . 0.0 108.297 172.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.534 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 88.9 t90 -56.48 -53.26 59.54 Favored 'General case' 0 N--CA 1.476 0.838 0 N-CA-C 112.138 0.422 . . . . 0.0 112.138 -174.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.461 ' O ' HG23 ' A' ' 32' ' ' VAL . 37.9 mt-10 -63.92 -32.29 73.77 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.942 0.877 . . . . 0.0 110.556 -177.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -73.91 -44.28 55.68 Favored 'General case' 0 C--N 1.293 -1.883 0 CA-C-N 114.46 -1.245 . . . . 0.0 110.412 -175.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.12 -34.63 90.49 Favored Glycine 0 C--O 1.221 -0.682 0 N-CA-C 111.212 -0.755 . . . . 0.0 111.212 174.504 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 2.8 tt -58.86 -51.17 71.14 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 107.805 -1.183 . . . . 0.0 107.805 176.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.461 HG23 ' O ' ' A' ' 28' ' ' GLU . 87.6 t -59.3 -38.21 73.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.502 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.89 -36.64 84.59 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.98 -0.555 . . . . 0.0 112.103 176.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 81.3 m -66.34 -43.47 86.02 Favored 'General case' 0 C--O 1.248 0.986 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 175.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -57.23 -29.88 64.13 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 115.914 -0.585 . . . . 0.0 110.577 178.719 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -56.92 -34.91 66.33 Favored Glycine 0 N--CA 1.443 -0.891 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.933 179.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.8 mptp? -101.44 11.57 38.89 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 109.715 -0.476 . . . . 0.0 109.715 179.222 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.78 14.07 82.93 Favored Glycine 0 C--O 1.245 0.794 0 CA-C-O 121.625 0.57 . . . . 0.0 111.763 -178.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -104.69 166.16 10.58 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -175.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.429 ' HB ' HD11 ' A' ' 80' ' ' ILE . 3.2 p -110.01 160.57 16.32 Favored 'General case' 0 C--N 1.28 -2.441 0 O-C-N 122.175 -0.328 . . . . 0.0 110.626 -179.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -75.52 124.69 27.61 Favored 'General case' 0 C--N 1.312 -1.049 0 N-CA-C 106.554 -1.647 . . . . 0.0 106.554 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 15.3 tpt -24.72 120.09 0.05 Allowed 'General case' 0 N--CA 1.499 2.017 0 N-CA-C 116.788 2.144 . . . . 0.0 116.788 -170.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -110.55 105.45 14.39 Favored 'General case' 0 C--O 1.241 0.641 0 C-N-CA 124.845 1.258 . . . . 0.0 107.62 178.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.517 HD13 HD11 ' A' ' 50' ' ' LEU . 34.2 mt -86.22 105.81 15.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 -176.162 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.7 tt0 -90.27 -22.69 21.47 Favored 'General case' 0 C--N 1.306 -1.311 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.731 -176.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.545 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 15.9 t70 -149.64 163.9 36.63 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 -170.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -64.65 -35.22 80.32 Favored 'General case' 0 C--N 1.312 -1.055 0 N-CA-C 109.678 -0.49 . . . . 0.0 109.678 176.253 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -60.56 -27.83 67.97 Favored 'General case' 0 CA--C 1.499 -0.983 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 178.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.545 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 13.3 mm-40 -57.54 -55.79 30.26 Favored 'General case' 0 N--CA 1.446 -0.662 0 N-CA-C 108.123 -1.065 . . . . 0.0 108.123 179.045 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.652 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 61.6 mt -71.88 -25.78 62.07 Favored 'General case' 0 CA--C 1.496 -1.125 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -177.508 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 -62.88 -38.01 89.2 Favored 'General case' 0 C--N 1.317 -0.824 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 174.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 69.2 t80 -68.06 -37.0 80.79 Favored 'General case' 0 N--CA 1.445 -0.697 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.692 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.5 mm? -62.48 -53.17 58.81 Favored 'General case' 0 C--O 1.206 -1.193 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 178.464 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.652 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 60.3 mt -56.49 -34.59 67.1 Favored 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 112.389 0.514 . . . . 0.0 112.389 -177.14 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.2 m-20 -73.56 -41.91 62.32 Favored 'General case' 0 CA--C 1.508 -0.659 0 N-CA-C 112.075 0.398 . . . . 0.0 112.075 176.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.3 p -81.4 -34.98 31.26 Favored 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 113.121 0.785 . . . . 0.0 113.121 -173.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.692 HG12 ' O ' ' A' ' 53' ' ' LEU . 51.0 mm -57.12 -45.73 84.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.544 0 CA-C-O 121.244 0.545 . . . . 0.0 109.655 179.241 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 52.0 tptt 68.96 -56.79 0.53 Allowed 'General case' 0 C--O 1.24 0.588 0 C-N-CA 124.895 1.278 . . . . 0.0 112.858 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -62.26 -52.18 64.75 Favored 'General case' 0 C--O 1.207 -1.156 0 N-CA-C 111.426 0.158 . . . . 0.0 111.426 -178.622 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.61 ' H ' HG22 ' A' ' 57' ' ' ILE . 97.6 mttt 73.86 -47.98 0.66 Allowed 'General case' 0 C--O 1.205 -1.27 0 C-N-CA 124.98 1.312 . . . . 0.0 112.712 -179.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -70.21 27.99 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 125.168 1.387 . . . . 0.0 114.058 -174.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.576 ' ND2' HE22 ' A' ' 22' ' ' GLN . 77.6 m-20 -115.29 -171.18 1.91 Allowed 'General case' 0 C--N 1.286 -2.186 0 N-CA-C 105.39 -2.078 . . . . 0.0 105.39 176.345 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.657 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 14.0 m -144.82 119.3 9.67 Favored 'General case' 0 N--CA 1.439 -1.011 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 179.333 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.532 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.5 m-85 -124.33 123.47 40.27 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 109.591 -0.522 . . . . 0.0 109.591 -176.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.533 ' CE2' ' HB2' ' A' ' 118' ' ' ASN . 78.0 m95 -62.17 138.86 58.47 Favored 'General case' 0 C--O 1.247 0.934 0 C-N-CA 123.182 0.593 . . . . 0.0 110.616 178.873 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -118.45 174.67 4.11 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.974 0 N-CA-C 106.798 -1.556 . . . . 0.0 106.798 169.371 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.619 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.41 47.52 2.39 Favored Glycine 0 C--O 1.21 -1.386 0 CA-C-N 118.728 0.695 . . . . 0.0 114.817 -173.805 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.494 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 17.3 mt -113.4 120.01 39.61 Favored 'General case' 0 CA--C 1.496 -1.125 0 C-N-CA 123.451 0.701 . . . . 0.0 111.901 179.275 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 16.4 ptt180 -126.4 140.38 52.53 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-N 115.776 -0.647 . . . . 0.0 109.291 176.565 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 19.4 t80 -91.06 124.5 35.34 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 107.732 -1.21 . . . . 0.0 107.732 178.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.448 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 35.5 p -105.97 117.86 35.11 Favored 'General case' 0 C--N 1.3 -1.572 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -175.397 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 57.6 mt -120.51 143.72 36.78 Favored Pre-proline 0 N--CA 1.439 -0.977 0 N-CA-C 109.26 -0.645 . . . . 0.0 109.26 174.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.54 126.62 11.24 Favored 'Cis proline' 0 C--O 1.243 0.772 0 C-N-CA 123.365 -1.515 . . . . 0.0 110.92 -4.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.448 ' HB3' ' O ' ' A' ' 71' ' ' THR . 12.9 t70 -177.7 -39.12 0.01 OUTLIER 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 106.816 -1.55 . . . . 0.0 106.816 -176.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 4.6 mpp? 67.15 16.33 10.21 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 125.568 1.547 . . . . 0.0 114.488 176.552 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -118.37 159.74 22.9 Favored 'General case' 0 C--O 1.258 1.509 0 CA-C-N 116.096 -0.502 . . . . 0.0 110.114 173.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 66.8 m95 -97.41 134.41 40.71 Favored 'General case' 0 C--N 1.306 -1.317 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 177.782 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -126.79 151.97 47.55 Favored 'General case' 0 C--N 1.288 -2.106 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.683 -178.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.619 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 37.0 m95 -93.63 169.93 9.96 Favored 'General case' 0 C--N 1.297 -1.701 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.429 HD11 ' HB ' ' A' ' 40' ' ' THR . 38.6 pt -69.38 -20.42 24.13 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.022 0 N-CA-C 112.327 0.492 . . . . 0.0 112.327 -177.046 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.4 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 31.3 p-10 -85.05 -14.14 48.24 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-O 121.655 0.741 . . . . 0.0 109.286 179.419 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.98 8.41 36.55 Favored Glycine 0 N--CA 1.443 -0.894 0 CA-C-N 115.336 -0.847 . . . . 0.0 112.363 176.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 39.8 m -74.97 163.42 27.64 Favored 'General case' 0 C--N 1.3 -1.568 0 CA-C-O 121.032 0.444 . . . . 0.0 111.692 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 19.9 m -98.96 140.4 33.16 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 176.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.574 HD11 HD12 ' A' ' 92' ' ' ILE . 43.5 tp -54.64 143.86 23.57 Favored 'General case' 0 C--N 1.31 -1.116 0 N-CA-C 113.728 1.01 . . . . 0.0 113.728 179.737 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -100.87 95.73 6.82 Favored 'General case' 0 N--CA 1.44 -0.929 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 170.149 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.0 m -71.39 -11.28 60.81 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-O 121.123 0.487 . . . . 0.0 111.814 -175.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -78.14 -12.49 60.0 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.752 1.019 . . . . 0.0 113.752 -176.325 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 29.2 m -75.3 -54.2 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.084 0 C-N-CA 119.079 -1.048 . . . . 0.0 112.473 -177.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.5 mt -152.03 -178.29 6.68 Favored 'General case' 0 C--O 1.239 0.53 0 N-CA-C 109.011 -0.737 . . . . 0.0 109.011 -177.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -68.33 111.88 4.87 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 114.792 1.404 . . . . 0.0 114.792 -176.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.574 HD12 HD11 ' A' ' 85' ' ' LEU . 9.7 mt -145.97 105.44 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.209 0 N-CA-C 107.089 -1.449 . . . . 0.0 107.089 174.314 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.0 m -61.06 128.99 39.16 Favored 'General case' 0 C--N 1.32 -0.706 0 C-N-CA 123.021 0.529 . . . . 0.0 109.899 -179.169 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -84.33 -53.33 3.3 Favored Glycine 0 N--CA 1.418 -2.516 0 N-CA-C 109.019 -1.632 . . . . 0.0 109.019 -176.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -93.23 82.56 4.53 Favored 'General case' 0 N--CA 1.421 -1.879 0 CA-C-O 122.767 1.27 . . . . 0.0 110.536 176.354 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 6.6 t -100.69 -24.01 14.51 Favored 'General case' 0 C--N 1.285 -2.2 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.587 178.841 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 63.46 17.63 10.47 Favored 'General case' 0 CA--C 1.557 1.221 0 C-N-CA 123.609 0.764 . . . . 0.0 112.218 178.196 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 64.9 m-80 -111.32 -178.68 3.51 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 114.069 1.137 . . . . 0.0 114.069 -176.106 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -86.67 26.93 1.03 Allowed 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 126.654 1.982 . . . . 0.0 109.798 179.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 11.5 m -72.1 150.72 43.63 Favored 'General case' 0 C--N 1.293 -1.867 0 N-CA-C 116.619 2.081 . . . . 0.0 116.619 -170.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -143.45 148.78 36.63 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 105.311 -2.107 . . . . 0.0 105.311 166.562 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -98.09 153.81 18.17 Favored 'General case' 0 C--N 1.31 -1.143 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 -169.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.25 150.2 38.95 Favored 'General case' 0 N--CA 1.445 -0.699 0 CA-C-N 114.62 -1.173 . . . . 0.0 109.376 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.657 ' O ' ' HA ' ' A' ' 63' ' ' SER . 17.5 mm -77.82 112.11 15.41 Favored 'Isoleucine or valine' 0 CA--C 1.485 -1.532 0 N-CA-C 106.627 -1.619 . . . . 0.0 106.627 173.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.564 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 8.8 t -134.04 100.6 4.77 Favored 'General case' 0 N--CA 1.401 -2.921 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 98.62 -134.43 11.69 Favored Glycine 0 C--N 1.276 -2.79 0 N-CA-C 109.36 -1.496 . . . . 0.0 109.36 -178.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -100.15 0.98 41.63 Favored 'General case' 0 C--N 1.291 -1.942 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 178.046 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -128.77 -176.66 3.91 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-N 115.234 -0.893 . . . . 0.0 110.315 -172.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.2 t -105.88 135.41 44.21 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.548 0 N-CA-C 105.874 -1.899 . . . . 0.0 105.874 176.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 71.2 p -131.32 175.08 9.43 Favored 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 106.406 -1.701 . . . . 0.0 106.406 176.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.2 p90 -146.5 156.91 43.61 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 119.94 1.245 . . . . 0.0 113.307 -177.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -161.3 -176.38 5.37 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 124.362 1.065 . . . . 0.0 109.67 -179.276 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 17.5 t -68.66 128.38 36.42 Favored 'General case' 0 C--O 1.21 -1.0 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 176.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.534 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 79.5 m -50.62 -12.93 0.11 Allowed 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 126.045 1.738 . . . . 0.0 115.202 -178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 -100.97 3.66 41.81 Favored 'General case' 0 C--N 1.288 -2.073 0 CA-C-N 116.325 -0.398 . . . . 0.0 111.279 -168.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 20.5 p -85.81 172.65 10.62 Favored 'General case' 0 N--CA 1.429 -1.5 0 CA-C-O 121.593 0.711 . . . . 0.0 111.522 177.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.54 123.07 26.68 Favored 'General case' 0 CA--C 1.496 -1.132 0 CA-C-N 115.174 -0.921 . . . . 0.0 111.227 175.974 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.533 ' HB2' ' CE2' ' A' ' 65' ' ' TRP . 74.5 m-20 -158.88 172.73 17.68 Favored 'General case' 0 CA--C 1.488 -1.439 0 C-N-CA 125.092 1.357 . . . . 0.0 107.421 172.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.69 ' HB3' ' O ' ' A' ' 21' ' ' SER . 2.2 mpt_? -100.96 -169.92 1.77 Allowed 'General case' 0 C--N 1.288 -2.077 0 N-CA-C 105.646 -1.983 . . . . 0.0 105.646 178.631 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 16.0 p90 -154.41 160.99 41.95 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-N 120.663 1.574 . . . . 0.0 112.573 -177.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 75.3 mt -120.83 125.54 74.18 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.66 0 CA-C-N 115.805 -0.634 . . . . 0.0 109.941 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 72.2 m -106.17 146.9 29.66 Favored 'General case' 0 C--N 1.293 -1.852 0 CA-C-N 115.559 -0.746 . . . . 0.0 109.109 177.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 8.4 pt20 -123.77 133.91 53.75 Favored 'General case' 0 N--CA 1.425 -1.718 0 N-CA-C 107.868 -1.16 . . . . 0.0 107.868 173.453 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 52.7 tttm -109.81 109.21 19.8 Favored 'General case' 0 C--N 1.272 -2.763 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 177.195 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -80.35 124.23 28.68 Favored 'General case' 0 C--N 1.307 -1.255 0 CA-C-O 121.353 0.597 . . . . 0.0 110.69 -172.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.636 HD21 ' SG ' ' A' ' 17' ' ' CYS . 2.9 mm? -75.82 -18.97 59.28 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.091 -178.271 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' TYR . . . . . 0.57 ' CD1' ' HB2' ' A' ' 15' ' ' ASP . 7.6 m-85 -94.87 22.99 5.86 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.274 -0.876 . . . . 0.0 112.045 178.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 59.7 t-80 -61.96 -37.62 85.44 Favored 'General case' 0 N--CA 1.469 0.498 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 175.61 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -102.54 94.9 5.9 Favored 'General case' 0 C--N 1.307 -1.244 0 N-CA-C 106.939 -1.504 . . . . 0.0 106.939 171.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . 0.401 ' HB ' HD22 ' A' ' 131' ' ' LEU . 17.5 m -88.05 -30.94 19.55 Favored 'General case' 0 C--N 1.302 -1.475 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 179.015 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.401 HD22 ' HB ' ' A' ' 130' ' ' THR . 2.9 mm? -120.36 130.26 54.32 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 108.386 -0.968 . . . . 0.0 108.386 177.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 66.0 m -88.95 89.32 7.94 Favored 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 107.265 -1.383 . . . . 0.0 107.265 172.562 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 13.9 m120 -65.31 -58.22 6.46 Favored 'General case' 0 CA--C 1.489 -1.397 0 CA-C-N 114.692 -1.14 . . . . 0.0 109.971 -174.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 60.4 t80 66.96 -0.92 1.53 Allowed 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 115.036 -0.984 . . . . 0.0 111.708 178.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 31.9 t 67.91 17.94 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.56 1.35 0 CA-C-O 123.05 1.405 . . . . 0.0 108.121 -173.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . -88.54 85.51 1.46 Allowed Glycine 0 N--CA 1.433 -1.516 0 N-CA-C 110.089 -1.204 . . . . 0.0 110.089 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 18.7 m-85 -105.17 10.71 33.71 Favored 'General case' 0 C--N 1.305 -1.349 0 CA-C-O 121.782 0.801 . . . . 0.0 109.141 -177.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 171.1 -49.25 0.19 Allowed Glycine 0 N--CA 1.428 -1.89 0 N-CA-C 109.262 -1.535 . . . . 0.0 109.262 -177.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 . . . . . 0 C--N 1.312 -1.029 0 N-CA-C 109.127 -0.694 . . . . 0.0 109.127 176.412 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.1 m . . . . . 0 CA--C 1.544 0.736 0 CA-C-O 120.585 0.231 . . . . 0.0 111.544 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.87 133.67 36.05 Favored 'General case' 0 N--CA 1.444 -0.733 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 178.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.667 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -62.94 163.56 9.5 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 121.068 0.461 . . . . 0.0 112.141 -178.565 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.667 ' O ' ' HG2' ' A' ' 3' ' ' LYS . 4.8 mp -91.78 -172.49 3.22 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 176.701 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -87.37 147.44 25.47 Favored 'General case' 0 C--N 1.298 -1.633 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -177.576 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.556 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 65.0 m -113.45 164.36 15.97 Favored Pre-proline 0 C--N 1.301 -1.508 0 CA-C-N 113.759 -1.564 . . . . 0.0 110.591 -177.1 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -62.29 164.06 18.59 Favored 'Trans proline' 0 C--N 1.367 1.501 0 C-N-CA 122.2 1.934 . . . . 0.0 112.377 175.469 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.5 pt20 -53.98 -35.66 62.06 Favored 'General case' 0 CA--C 1.551 0.99 0 N-CA-C 114.67 1.359 . . . . 0.0 114.67 -174.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.55 4.76 50.31 Favored 'General case' 0 C--N 1.317 -0.809 0 O-C-N 121.986 -0.446 . . . . 0.0 111.418 -175.049 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 24.9 m95 -112.89 145.93 39.85 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-O 120.821 0.343 . . . . 0.0 110.973 -174.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.426 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.1 mm? -100.62 178.83 4.6 Favored 'General case' 0 C--N 1.313 -1.017 0 N-CA-C 105.271 -2.122 . . . . 0.0 105.271 173.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.556 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 56.1 p -155.89 148.81 24.25 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 119.525 1.057 . . . . 0.0 113.334 179.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 29.2 t-80 -154.37 135.96 14.32 Favored 'General case' 0 C--N 1.321 -0.66 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 179.044 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 22.0 mmt180 67.83 -70.87 0.11 Allowed 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.625 1.17 . . . . 0.0 113.828 176.34 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.454 ' C ' ' HD3' ' A' ' 16' ' ' LYS . 9.4 p-10 -167.31 24.69 0.03 OUTLIER 'General case' 0 C--N 1.305 -1.361 0 CA-C-N 115.544 -0.753 . . . . 0.0 109.839 -174.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.454 ' HD3' ' C ' ' A' ' 15' ' ' ASP . 3.9 mppt? -144.5 143.8 31.03 Favored 'General case' 0 CA--C 1.511 -0.547 0 C-N-CA 122.834 0.454 . . . . 0.0 110.358 -178.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.563 ' O ' ' HA ' ' A' ' 123' ' ' GLN . 15.2 m -97.1 151.36 19.84 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 174.306 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 33.1 m-85 -130.77 134.04 46.52 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 118.486 0.585 . . . . 0.0 110.046 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 -119.76 108.94 15.02 Favored 'General case' 0 C--N 1.297 -1.685 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 175.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.6 t -83.87 93.79 3.29 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 N-CA-C 106.69 -1.596 . . . . 0.0 106.69 175.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.778 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 8.5 m -77.67 110.8 12.81 Favored 'General case' 0 N--CA 1.421 -1.899 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.243 -177.538 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -83.44 14.35 3.75 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.889 0.876 . . . . 0.0 112.962 -178.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.59 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 6.7 m -107.14 153.55 8.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.921 0 N-CA-C 107.628 -1.249 . . . . 0.0 107.628 -179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 29.7 m -108.83 143.96 37.32 Favored 'General case' 0 C--N 1.3 -1.543 0 N-CA-C 114.494 1.294 . . . . 0.0 114.494 -173.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 58.9 m-20 -154.3 172.98 16.8 Favored 'General case' 0 C--N 1.32 -0.693 0 C-N-CA 126.476 1.91 . . . . 0.0 108.994 -179.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.4 p -77.86 166.68 22.61 Favored 'General case' 0 N--CA 1.431 -1.378 0 N-CA-C 107.451 -1.314 . . . . 0.0 107.451 171.224 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.1 t90 -56.56 -50.96 70.35 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 121.337 0.589 . . . . 0.0 111.477 -175.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.532 ' H ' ' CD ' ' A' ' 28' ' ' GLU . 0.1 OUTLIER -65.92 -35.95 82.04 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-N 115.43 -0.805 . . . . 0.0 110.993 -176.615 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -66.3 -45.06 81.69 Favored 'General case' 0 N--CA 1.433 -1.315 0 CA-C-N 116.059 -0.519 . . . . 0.0 109.832 -179.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.65 -32.24 82.76 Favored Glycine 0 N--CA 1.465 0.594 0 C-N-CA 121.39 -0.434 . . . . 0.0 112.388 176.415 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tt -61.28 -51.52 68.56 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 176.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 58.8 t -61.92 -32.08 53.1 Favored 'Isoleucine or valine' 0 C--O 1.244 0.803 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.331 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.547 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 0.9 OUTLIER -61.65 -45.3 94.64 Favored 'General case' 0 CA--C 1.501 -0.935 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.853 174.835 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 60.5 m -64.25 -41.92 96.74 Favored 'General case' 0 C--O 1.244 0.771 0 N-CA-C 110.013 -0.366 . . . . 0.0 110.013 179.32 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 82.0 m-20 -56.69 -38.05 71.74 Favored 'General case' 0 N--CA 1.473 0.717 0 O-C-N 123.793 0.683 . . . . 0.0 109.637 176.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.26 -23.15 61.8 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-N 114.913 -1.039 . . . . 0.0 114.036 179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.547 ' HD2' ' O ' ' A' ' 33' ' ' ASP . 2.1 mptp? -97.27 2.73 51.14 Favored 'General case' 0 CA--C 1.511 -0.557 0 CA-C-N 117.915 0.857 . . . . 0.0 110.711 177.284 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 70.93 50.01 25.68 Favored Glycine 0 N--CA 1.442 -0.945 0 N-CA-C 108.499 -1.84 . . . . 0.0 108.499 -173.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.572 ' HB1' ' O ' ' A' ' 123' ' ' GLN . . . -147.82 176.77 9.87 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 108.036 -1.098 . . . . 0.0 108.036 -178.626 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.402 ' HB ' HD11 ' A' ' 80' ' ' ILE . 1.6 p -116.14 164.86 13.86 Favored 'General case' 0 C--N 1.292 -1.917 0 C-N-CA 122.798 0.439 . . . . 0.0 110.684 179.784 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.0 tp -80.96 127.95 33.14 Favored 'General case' 0 C--N 1.315 -0.923 0 N-CA-C 105.936 -1.876 . . . . 0.0 105.936 174.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.3 tpt -28.73 122.4 0.12 Allowed 'General case' 0 N--CA 1.499 2.014 0 N-CA-C 116.923 2.194 . . . . 0.0 116.923 -169.562 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -114.68 108.86 17.36 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 125.345 1.458 . . . . 0.0 107.387 177.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.499 HD13 HD11 ' A' ' 50' ' ' LEU . 52.9 mt -88.88 110.57 21.54 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 CA-C-O 121.152 0.501 . . . . 0.0 111.512 -173.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 63.9 tt0 -79.97 -32.32 39.85 Favored 'General case' 0 CA--C 1.545 0.781 0 CA-C-N 115.189 -0.914 . . . . 0.0 111.794 -177.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -158.59 169.33 24.66 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 109.54 -0.541 . . . . 0.0 109.54 -177.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.4 -34.34 76.54 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 123.496 0.718 . . . . 0.0 109.62 178.507 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.499 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 12.0 pt-20 -58.38 -27.31 64.12 Favored 'General case' 0 C--O 1.243 0.723 0 C-N-CA 122.886 0.474 . . . . 0.0 111.363 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -66.92 -54.35 22.95 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 177.301 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.51 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 37.7 mt -66.65 -26.95 67.3 Favored 'General case' 0 CA--C 1.488 -1.415 0 N-CA-C 113.723 1.009 . . . . 0.0 113.723 -178.328 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.499 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 20.3 ptt180 -68.58 -32.02 71.64 Favored 'General case' 0 N--CA 1.43 -1.428 0 C-N-CA 119.331 -0.948 . . . . 0.0 109.363 178.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 76.0 t80 -74.26 -27.99 61.0 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 174.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.693 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -65.17 -48.15 74.48 Favored 'General case' 0 C--O 1.193 -1.906 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 175.429 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.51 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 46.3 mt -57.78 -33.43 68.52 Favored 'General case' 0 C--N 1.318 -0.79 0 O-C-N 123.412 0.445 . . . . 0.0 111.464 -179.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 -63.92 -41.76 97.57 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.551 175.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 11.3 p -88.27 -24.64 23.15 Favored 'General case' 0 C--N 1.314 -0.947 0 N-CA-C 113.469 0.914 . . . . 0.0 113.469 -176.045 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.693 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.8 mm -56.33 -47.77 80.76 Favored 'Isoleucine or valine' 0 C--O 1.243 0.731 0 C-N-CA 123.603 0.761 . . . . 0.0 111.081 178.278 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 52.5 tptt 67.98 -69.65 0.14 Allowed 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 124.916 1.286 . . . . 0.0 113.696 179.439 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -65.55 -34.56 78.53 Favored 'General case' 0 C--O 1.21 -1.01 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 -175.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.585 ' H ' HG22 ' A' ' 57' ' ' ILE . 49.4 mttp 72.98 -57.19 0.64 Allowed 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 124.755 1.222 . . . . 0.0 112.354 177.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 26.8 m-85 -68.74 6.55 0.83 Allowed 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.168 1.387 . . . . 0.0 114.407 -170.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.593 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 51.2 m-80 -82.63 -168.49 2.04 Favored 'General case' 0 C--N 1.305 -1.34 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 173.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.437 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 8.3 m -140.22 114.51 9.19 Favored 'General case' 0 C--N 1.295 -1.776 0 N-CA-C 106.704 -1.591 . . . . 0.0 106.704 177.134 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.593 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 4.9 m-85 -121.55 120.11 33.9 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 120.925 -0.31 . . . . 0.0 110.267 -177.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.42 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 55.0 m95 -62.81 137.59 58.31 Favored 'General case' 0 C--N 1.309 -1.161 0 C-N-CA 123.067 0.547 . . . . 0.0 111.071 179.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.88 177.33 2.08 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 167.636 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.693 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.28 54.07 3.55 Favored Glycine 0 C--O 1.199 -2.07 0 C-N-CA 120.184 -1.008 . . . . 0.0 113.382 -176.511 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 35.1 mt -126.52 118.28 24.58 Favored 'General case' 0 CA--C 1.489 -1.383 0 C-N-CA 123.55 0.74 . . . . 0.0 111.689 -179.194 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -133.73 141.49 47.55 Favored 'General case' 0 C--N 1.295 -1.763 0 N-CA-C 109.249 -0.648 . . . . 0.0 109.249 173.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.449 ' HE1' ' O ' ' A' ' 94' ' ' GLY . 59.1 t80 -86.14 112.59 21.45 Favored 'General case' 0 N--CA 1.429 -1.505 0 N-CA-C 104.26 -2.496 . . . . 0.0 104.26 175.914 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.48 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 1.2 p -85.68 119.75 26.37 Favored 'General case' 0 C--N 1.274 -2.681 0 N-CA-C 112.556 0.576 . . . . 0.0 112.556 -173.574 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 70.4 mt -120.55 133.2 24.01 Favored Pre-proline 0 N--CA 1.432 -1.348 0 C-N-CA 120.409 -0.516 . . . . 0.0 110.869 174.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -85.73 135.97 20.18 Favored 'Cis proline' 0 CA--C 1.55 1.288 0 C-N-CA 122.791 -1.754 . . . . 0.0 111.287 -2.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.48 ' HB3' ' O ' ' A' ' 71' ' ' THR . 14.4 t70 173.37 -39.72 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.352 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 -175.441 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 2.1 mpt? 63.94 19.44 11.75 Favored 'General case' 0 C--O 1.235 0.29 0 C-N-CA 126.756 2.023 . . . . 0.0 115.381 174.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -120.56 162.31 19.84 Favored 'General case' 0 C--N 1.307 -1.26 0 O-C-N 122.145 -0.347 . . . . 0.0 110.112 176.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -95.27 111.46 23.31 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 175.313 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -114.38 147.65 38.86 Favored 'General case' 0 C--N 1.283 -2.308 0 CA-C-N 115.628 -0.714 . . . . 0.0 111.102 -178.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.693 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 49.0 m95 -93.4 169.21 10.54 Favored 'General case' 0 N--CA 1.429 -1.522 0 CA-C-N 114.772 -1.103 . . . . 0.0 108.55 178.282 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.402 HD11 ' HB ' ' A' ' 40' ' ' THR . 40.8 pt -71.83 -13.9 17.11 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.065 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.909 -178.838 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.541 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 33.7 p-10 -89.84 -11.0 43.29 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-O 121.485 0.659 . . . . 0.0 109.402 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.12 1.05 44.84 Favored Glycine 0 CA--C 1.499 -0.918 0 CA-C-N 115.324 -0.853 . . . . 0.0 112.155 174.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 57.2 m -80.04 165.77 22.21 Favored 'General case' 0 C--N 1.294 -1.847 0 C-N-CA 122.834 0.454 . . . . 0.0 111.939 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.3 m -105.05 141.87 35.85 Favored 'General case' 0 N--CA 1.427 -1.613 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 176.322 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.447 HD11 HD12 ' A' ' 92' ' ' ILE . 39.0 tp -56.91 140.21 49.21 Favored 'General case' 0 C--N 1.3 -1.576 0 C-N-CA 124.98 1.312 . . . . 0.0 113.845 178.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 41.4 t30 -95.2 98.39 10.59 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 106.514 -1.662 . . . . 0.0 106.514 166.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 11.4 p -70.61 -8.68 53.48 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 112.386 0.513 . . . . 0.0 112.386 -175.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 45.3 m-20 -78.44 -6.0 54.06 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 114.639 1.348 . . . . 0.0 114.639 -178.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 27.5 m -74.73 -48.22 34.9 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.634 0 C-N-CA 119.045 -1.062 . . . . 0.0 111.266 178.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.1 mt -153.78 177.56 10.85 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 -177.717 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.89 109.51 2.11 Favored 'General case' 0 CA--C 1.499 -1.001 0 N-CA-C 114.443 1.275 . . . . 0.0 114.443 -179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.447 HD12 HD11 ' A' ' 85' ' ' LEU . 9.4 mt -146.66 106.3 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.296 -1.751 0 N-CA-C 105.607 -1.997 . . . . 0.0 105.607 171.072 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 10.7 m -63.97 122.26 16.07 Favored 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 -179.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.449 ' O ' ' HE1' ' A' ' 70' ' ' TYR . . . -89.54 -19.53 48.43 Favored Glycine 0 N--CA 1.419 -2.445 0 N-CA-C 111.001 -0.84 . . . . 0.0 111.001 -174.442 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 16.1 t70 -122.3 104.84 9.7 Favored 'General case' 0 N--CA 1.422 -1.825 0 N-CA-C 108.033 -1.099 . . . . 0.0 108.033 175.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.489 HG23 ' H ' ' A' ' 98' ' ' ASN . 12.3 t -141.36 -26.05 0.7 Allowed 'General case' 0 C--N 1.281 -2.371 0 CA-C-N 115.326 -0.852 . . . . 0.0 112.4 -173.578 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 62.67 29.41 16.85 Favored 'General case' 0 CA--C 1.534 0.338 0 N-CA-C 113.938 1.088 . . . . 0.0 113.938 179.602 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.489 ' H ' HG23 ' A' ' 96' ' ' THR . 40.6 m-80 -122.53 143.84 49.47 Favored 'General case' 0 C--O 1.205 -1.282 0 N-CA-C 108.63 -0.878 . . . . 0.0 108.63 175.683 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -82.55 27.32 0.52 Allowed 'General case' 0 N--CA 1.505 2.303 0 C-N-CA 125.049 1.34 . . . . 0.0 110.622 -172.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.437 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 32.8 t -74.09 158.29 34.51 Favored 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 125.782 1.633 . . . . 0.0 112.276 -173.572 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 88.5 m -117.31 143.88 45.46 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 177.324 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -89.45 143.12 27.07 Favored 'General case' 0 C--O 1.251 1.165 0 CA-C-O 121.427 0.632 . . . . 0.0 112.154 -175.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -141.07 151.74 44.26 Favored 'General case' 0 N--CA 1.435 -1.181 0 CA-C-N 115.225 -0.898 . . . . 0.0 110.556 -178.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.439 HD11 HD22 ' A' ' 50' ' ' LEU . 13.9 mm -77.48 121.77 30.74 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.643 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 175.243 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 8.8 t -145.32 97.31 2.98 Favored 'General case' 0 N--CA 1.413 -2.318 0 N-CA-C 108.58 -0.896 . . . . 0.0 108.58 176.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 100.71 -119.83 6.66 Favored Glycine 0 C--N 1.283 -2.374 0 CA-C-N 114.317 -1.31 . . . . 0.0 110.186 179.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.506 ' OD2' ' HE2' ' A' ' 108' ' ' LYS . 6.5 p-10 -115.19 8.52 15.59 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 123.323 0.649 . . . . 0.0 109.249 177.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.506 ' HE2' ' OD2' ' A' ' 107' ' ' ASP . 74.4 mmtt -134.92 174.69 10.32 Favored 'General case' 0 N--CA 1.437 -1.096 0 CA-C-N 115.479 -0.782 . . . . 0.0 110.486 -176.266 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.3 t -101.39 130.65 50.59 Favored 'Isoleucine or valine' 0 N--CA 1.418 -2.031 0 N-CA-C 105.357 -2.09 . . . . 0.0 105.357 175.83 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 59.1 p -131.6 141.83 49.75 Favored 'General case' 0 C--N 1.272 -2.788 0 N-CA-C 107.113 -1.44 . . . . 0.0 107.113 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.437 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 6.8 p90 -99.79 133.1 44.64 Favored 'General case' 0 C--N 1.287 -2.115 0 N-CA-C 113.001 0.741 . . . . 0.0 113.001 -177.78 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -121.1 165.75 14.89 Favored 'General case' 0 C--N 1.308 -1.239 0 CA-C-N 114.427 -1.261 . . . . 0.0 107.622 -174.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 38.2 m -64.74 130.59 44.11 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 106.924 -1.51 . . . . 0.0 106.924 171.428 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 8.5 m -59.98 -19.64 53.35 Favored 'General case' 0 N--CA 1.484 1.227 0 CA-C-O 121.417 0.627 . . . . 0.0 111.434 -175.471 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.5 p30 -93.38 4.39 54.04 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.255 1.022 . . . . 0.0 112.574 -179.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 34.4 p -73.54 -7.95 53.96 Favored 'General case' 0 N--CA 1.491 1.582 0 N-CA-C 114.024 1.12 . . . . 0.0 114.024 -173.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 13.8 t70 62.64 87.48 0.1 Allowed 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.628 1.171 . . . . 0.0 110.392 -179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 93.7 m-20 -127.81 175.07 8.61 Favored 'General case' 0 C--N 1.295 -1.794 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 -177.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.778 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.2 mpt_? -83.43 -174.7 5.44 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 -177.739 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.447 ' CH2' HG23 ' A' ' 23' ' ' VAL . 26.9 p90 -156.58 172.72 18.08 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 119.659 1.118 . . . . 0.0 112.132 -177.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 85.5 mt -126.44 122.59 61.48 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.789 0 CA-C-O 121.417 0.627 . . . . 0.0 110.128 178.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 74.3 m -100.12 143.72 29.99 Favored 'General case' 0 C--N 1.29 -2.022 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 175.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.572 ' O ' ' HB1' ' A' ' 39' ' ' ALA . 6.3 pt20 -121.54 154.06 37.18 Favored 'General case' 0 N--CA 1.417 -2.089 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 173.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.404 ' HB3' ' HB2' ' A' ' 17' ' ' CYS . 21.6 ttmm -132.33 110.47 10.6 Favored 'General case' 0 C--N 1.268 -2.95 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 176.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.454 ' HG3' ' ND1' ' A' ' 128' ' ' HIS . 0.8 OUTLIER -75.9 118.33 18.58 Favored 'General case' 0 C--N 1.282 -2.338 0 CA-C-O 121.648 0.737 . . . . 0.0 111.96 -177.304 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.65 ' HB3' HD13 ' A' ' 4' ' ' LEU . 2.6 mm? -69.12 -40.17 78.48 Favored 'General case' 0 N--CA 1.435 -1.201 0 CA-C-N 114.852 -1.067 . . . . 0.0 108.414 176.766 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 36.1 p90 -156.11 95.8 1.64 Allowed 'General case' 0 C--O 1.207 -1.165 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.703 174.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . 0.454 ' ND1' ' HG3' ' A' ' 125' ' ' GLU . 1.3 p-80 -79.28 151.81 30.9 Favored 'General case' 0 C--O 1.25 1.086 0 C-N-CA 118.973 -1.091 . . . . 0.0 108.809 173.087 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 53.5 mm-40 71.65 -172.82 0.16 Allowed 'General case' 0 N--CA 1.469 0.49 0 O-C-N 124.3 1.0 . . . . 0.0 109.657 -175.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 59.5 m -140.0 129.52 24.22 Favored 'General case' 0 C--N 1.288 -2.099 0 N-CA-C 107.459 -1.311 . . . . 0.0 107.459 176.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.407 ' H ' HD22 ' A' ' 131' ' ' LEU . 2.0 mm? -73.75 -42.75 60.68 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.794 -0.639 . . . . 0.0 111.478 -170.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 13.9 t -96.26 140.08 31.46 Favored 'General case' 0 N--CA 1.42 -1.933 0 N-CA-C 107.841 -1.17 . . . . 0.0 107.841 178.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -115.28 -92.22 0.51 Allowed 'General case' 0 C--N 1.309 -1.177 0 C-N-CA 119.879 -0.729 . . . . 0.0 111.89 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -147.99 132.38 17.58 Favored 'General case' 0 C--N 1.308 -1.201 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 -174.217 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 21.4 t -103.82 -8.44 9.53 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.516 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 175.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 97.22 -109.77 3.9 Favored Glycine 0 N--CA 1.43 -1.746 0 N-CA-C 109.37 -1.492 . . . . 0.0 109.37 -179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 85.9 m-85 -112.38 7.29 19.13 Favored 'General case' 0 C--N 1.296 -1.743 0 N-CA-C 107.965 -1.124 . . . . 0.0 107.965 175.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 77.63 79.73 0.71 Allowed Glycine 0 N--CA 1.427 -1.951 0 N-CA-C 109.298 -1.521 . . . . 0.0 109.298 -176.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 37.3 t60 . . . . . 0 C--N 1.304 -1.391 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -176.302 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . 0.494 ' H2 ' ' CG ' ' A' ' 15' ' ' ASP . 15.2 m . . . . . 0 N--CA 1.437 -1.123 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.401 ' O ' ' HB3' ' A' ' 3' ' ' LYS . . . -157.22 -38.71 0.07 Allowed 'General case' 0 CA--C 1.5 -0.966 0 C-N-CA 120.453 -0.499 . . . . 0.0 111.165 -175.591 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.503 ' HB3' ' NZ ' ' A' ' 3' ' ' LYS . 3.5 ttpm? 71.06 113.69 0.05 Allowed 'General case' 0 N--CA 1.444 -0.745 0 O-C-N 124.327 1.017 . . . . 0.0 111.66 -174.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.434 HD13 ' HG ' ' A' ' 126' ' ' LEU . 2.2 mp -85.61 -163.09 0.8 Allowed 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 178.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -99.21 140.14 33.82 Favored 'General case' 0 C--N 1.304 -1.37 0 C-N-CA 119.168 -1.013 . . . . 0.0 111.8 178.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.547 ' SG ' ' HB3' ' A' ' 12' ' ' SER . 65.7 m -101.93 161.91 22.0 Favored Pre-proline 0 C--N 1.309 -1.179 0 CA-C-N 114.939 -1.028 . . . . 0.0 109.665 -176.03 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.602 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 31.8 Cg_exo -61.81 156.37 48.93 Favored 'Trans proline' 0 CA--C 1.555 1.562 0 C-N-CA 121.612 1.541 . . . . 0.0 109.854 173.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -51.71 -33.66 35.34 Favored 'General case' 0 N--CA 1.483 1.209 0 N-CA-C 116.528 2.048 . . . . 0.0 116.528 -169.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.4 m-20 -97.71 5.77 48.83 Favored 'General case' 0 C--N 1.308 -1.215 0 O-C-N 121.714 -0.616 . . . . 0.0 111.887 -174.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.602 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 17.3 m95 -101.14 135.95 41.78 Favored 'General case' 0 C--N 1.304 -1.409 0 CA-C-O 120.647 0.261 . . . . 0.0 111.302 -174.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.409 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.5 mm? -93.83 130.4 39.88 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.868 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.547 ' HB3' ' SG ' ' A' ' 6' ' ' CYS . 25.8 p -96.43 130.25 43.61 Favored 'General case' 0 C--N 1.295 -1.797 0 N-CA-C 113.168 0.803 . . . . 0.0 113.168 -175.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -151.09 119.44 6.39 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.044 -0.525 . . . . 0.0 109.954 179.547 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.407 ' HD3' ' OE1' ' A' ' 48' ' ' GLU . 21.8 mtm180 54.68 46.36 24.85 Favored 'General case' 0 C--N 1.315 -0.899 0 C-N-CA 125.849 1.659 . . . . 0.0 112.796 175.315 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.543 ' OD1' ' HE1' ' A' ' 127' ' ' TYR . 14.5 m-20 69.73 36.27 2.15 Favored 'General case' 0 N--CA 1.487 1.404 0 C-N-CA 124.136 0.974 . . . . 0.0 111.026 179.482 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.464 ' O ' ' HA ' ' A' ' 12' ' ' SER . 10.2 mptt -141.72 159.83 41.42 Favored 'General case' 0 CA--C 1.499 -1.001 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 174.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.709 ' SG ' HD13 ' A' ' 126' ' ' LEU . 4.6 m -129.44 132.26 46.93 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 107.036 -1.468 . . . . 0.0 107.036 177.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.407 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 19.3 m-85 -111.41 137.28 49.4 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 117.911 0.323 . . . . 0.0 110.832 -177.157 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.452 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 42.3 t-80 -121.11 108.33 13.67 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 108.087 -1.079 . . . . 0.0 108.087 175.276 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.7 t -88.22 93.59 4.31 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.727 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 176.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.73 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 4.1 m -77.76 113.56 15.75 Favored 'General case' 0 C--N 1.296 -1.742 0 CA-C-N 115.4 -0.818 . . . . 0.0 109.053 -177.079 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.473 ' C ' ' HG2' ' A' ' 119' ' ' ARG . 13.4 mm100 -85.0 14.36 5.02 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.803 0.841 . . . . 0.0 111.962 -179.626 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.485 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 13.9 m -105.68 157.21 6.38 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.872 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 179.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 14.2 m -110.4 147.29 34.3 Favored 'General case' 0 C--N 1.295 -1.762 0 N-CA-C 114.166 1.173 . . . . 0.0 114.166 -169.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.446 ' HB3' ' HB3' ' A' ' 29' ' ' GLU . 35.2 m-20 -159.73 -178.07 6.81 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 126.491 1.916 . . . . 0.0 108.7 -178.555 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 71.2 p -86.5 170.38 11.98 Favored 'General case' 0 N--CA 1.432 -1.362 0 N-CA-C 106.614 -1.625 . . . . 0.0 106.614 171.454 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 87.9 t90 -59.91 -51.58 69.09 Favored 'General case' 0 C--N 1.309 -1.179 0 CA-C-O 121.016 0.436 . . . . 0.0 110.43 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.483 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 49.9 mt-10 -67.47 -31.23 71.24 Favored 'General case' 0 CA--C 1.538 0.49 0 CA-C-N 116.131 -0.486 . . . . 0.0 111.726 -177.291 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.446 ' HB3' ' HB3' ' A' ' 25' ' ' ASN . 7.8 tp10 -67.21 -49.55 64.13 Favored 'General case' 0 N--CA 1.433 -1.317 0 N-CA-C 109.571 -0.529 . . . . 0.0 109.571 177.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.88 -31.92 80.1 Favored Glycine 0 C--N 1.344 0.975 0 CA-C-N 116.036 -0.529 . . . . 0.0 111.782 178.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.483 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 3.1 tm? -55.2 -51.29 67.03 Favored 'General case' 0 C--O 1.251 1.158 0 C-N-CA 124.17 0.988 . . . . 0.0 109.04 176.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 57.5 t -67.06 -35.09 73.64 Favored 'Isoleucine or valine' 0 C--O 1.247 0.922 0 CA-C-N 115.791 -0.641 . . . . 0.0 110.468 179.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -59.43 -36.55 76.1 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.283 0.475 . . . . 0.0 112.283 176.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 61.8 m -70.61 -41.86 71.72 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.686 -0.234 . . . . 0.0 110.417 177.047 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -61.74 -25.66 67.58 Favored 'General case' 0 N--CA 1.482 1.153 0 N-CA-C 112.172 0.434 . . . . 0.0 112.172 -179.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.88 -37.16 93.89 Favored Glycine 0 N--CA 1.447 -0.632 0 CA-C-N 115.761 -0.654 . . . . 0.0 113.199 179.557 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 12.7 mptt -86.46 2.73 46.77 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 122.858 -0.201 . . . . 0.0 110.779 -179.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.52 41.38 30.02 Favored Glycine 0 N--CA 1.435 -1.371 0 N-CA-C 108.665 -1.774 . . . . 0.0 108.665 -174.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -132.83 177.07 7.92 Favored 'General case' 0 N--CA 1.422 -1.872 0 CA-C-N 114.783 -0.708 . . . . 0.0 109.227 -176.808 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.486 ' HB ' HD11 ' A' ' 80' ' ' ILE . 2.7 p -120.9 154.04 36.41 Favored 'General case' 0 C--N 1.279 -2.479 0 O-C-N 123.634 0.584 . . . . 0.0 109.498 -179.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.6 tp -66.05 139.81 58.22 Favored 'General case' 0 C--N 1.308 -1.214 0 N-CA-C 105.756 -1.942 . . . . 0.0 105.756 172.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.9 tpt -35.82 118.75 0.52 Allowed 'General case' 0 N--CA 1.489 1.489 0 N-CA-C 114.681 1.364 . . . . 0.0 114.681 -170.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 16.0 tp -120.51 106.35 11.72 Favored 'General case' 0 C--N 1.313 -0.999 0 N-CA-C 106.89 -1.522 . . . . 0.0 106.89 -174.525 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.521 HD13 HD11 ' A' ' 50' ' ' LEU . 30.7 mt -98.05 112.96 31.33 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.927 0 CA-C-O 121.25 0.548 . . . . 0.0 111.949 -169.04 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -90.16 -31.22 17.16 Favored 'General case' 0 C--N 1.305 -1.363 0 CA-C-N 115.069 -0.969 . . . . 0.0 111.67 179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -143.65 161.54 38.27 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 109.295 -0.631 . . . . 0.0 109.295 -173.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.505 ' NE2' ' HA ' ' A' ' 89' ' ' VAL . 6.9 tt0 -74.32 -25.36 59.51 Favored 'General case' 0 C--N 1.302 -1.48 0 C-N-CA 122.536 0.334 . . . . 0.0 110.565 -178.332 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.657 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 7.7 pt-20 -69.08 -26.13 64.79 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 120.316 -0.554 . . . . 0.0 110.935 176.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -57.27 -54.1 50.62 Favored 'General case' 0 N--CA 1.447 -0.608 0 N-CA-C 106.66 -1.607 . . . . 0.0 106.66 173.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.521 HD11 HD13 ' A' ' 44' ' ' ILE . 62.4 mt -67.69 -26.8 66.36 Favored 'General case' 0 CA--C 1.504 -0.823 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -179.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.657 ' HG3' ' O ' ' A' ' 48' ' ' GLU . 4.1 ppt_? -66.45 -36.6 83.18 Favored 'General case' 0 N--CA 1.439 -1.003 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 176.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 57.6 t80 -73.44 -25.74 60.64 Favored 'General case' 0 N--CA 1.441 -0.924 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.468 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.674 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -63.53 -48.82 75.96 Favored 'General case' 0 CA--C 1.477 -1.848 0 N-CA-C 108.94 -0.763 . . . . 0.0 108.94 172.941 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.485 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 37.7 mt -55.12 -38.8 68.65 Favored 'General case' 0 C--O 1.244 0.784 0 O-C-N 123.756 0.66 . . . . 0.0 110.717 177.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -59.16 -43.19 92.1 Favored 'General case' 0 N--CA 1.467 0.396 0 CA-C-N 115.679 -0.691 . . . . 0.0 110.73 175.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 48.8 p -81.26 -27.01 35.34 Favored 'General case' 0 CA--C 1.551 0.988 0 N-CA-C 112.549 0.574 . . . . 0.0 112.549 179.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 53' ' ' LEU . 32.7 mm -67.1 -58.21 7.17 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.562 0 N-CA-C 110.21 -0.293 . . . . 0.0 110.21 -178.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.3 tppp? 67.36 -59.07 0.41 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.84 0.856 . . . . 0.0 112.921 -179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.3 mt-10 -61.04 -60.36 3.9 Favored 'General case' 0 C--O 1.211 -0.94 0 C-N-CA 123.079 0.552 . . . . 0.0 112.418 -175.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 45.8 mtmt 71.16 15.51 6.47 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.9 0.88 . . . . 0.0 113.044 179.442 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 67.0 m-85 -125.59 30.84 5.66 Favored 'General case' 0 C--N 1.317 -0.837 0 CA-C-O 121.631 0.729 . . . . 0.0 111.62 -179.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.479 ' O ' ' HA ' ' A' ' 105' ' ' SER . 65.2 m-80 -127.11 -159.66 0.95 Allowed 'General case' 0 C--N 1.303 -1.453 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 175.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.612 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 54.7 m -151.97 126.68 9.54 Favored 'General case' 0 C--O 1.25 1.107 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 173.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.548 ' CE2' HD12 ' A' ' 57' ' ' ILE . 1.1 m-85 -128.83 118.78 23.32 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 -176.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.408 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 70.3 m95 -59.38 140.14 56.39 Favored 'General case' 0 C--N 1.314 -0.951 0 C-N-CA 123.804 0.842 . . . . 0.0 112.018 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -119.53 174.48 4.78 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.0 0 N-CA-C 106.283 -1.747 . . . . 0.0 106.283 169.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.646 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.84 58.54 3.48 Favored Glycine 0 C--O 1.205 -1.703 0 CA-C-N 119.294 0.952 . . . . 0.0 113.76 -175.006 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.9 mt -127.44 113.86 16.74 Favored 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 123.743 0.817 . . . . 0.0 111.282 179.714 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -122.42 137.65 54.8 Favored 'General case' 0 C--N 1.307 -1.249 0 N-CA-C 109.713 -0.477 . . . . 0.0 109.713 176.553 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 36.7 t80 -93.52 113.06 25.09 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 107.397 -1.334 . . . . 0.0 107.397 179.425 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.48 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 9.3 p -102.72 126.49 49.84 Favored 'General case' 0 C--N 1.293 -1.875 0 CA-C-N 115.926 -0.579 . . . . 0.0 112.413 -174.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.52 HD11 ' HA ' ' A' ' 97' ' ' GLU . 57.7 mt -120.69 144.88 39.76 Favored Pre-proline 0 C--N 1.31 -1.125 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 174.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -83.27 128.15 13.36 Favored 'Cis proline' 0 N--CA 1.457 -0.667 0 C-N-CA 123.366 -1.514 . . . . 0.0 111.574 -1.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.48 ' HB3' ' O ' ' A' ' 71' ' ' THR . 27.7 t70 179.94 -46.45 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.502 0.721 . . . . 0.0 109.505 -177.008 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 86.2 mtp 70.54 17.58 6.72 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 175.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -120.64 145.14 47.71 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 120.589 -0.445 . . . . 0.0 110.359 175.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 84.4 m95 -87.88 125.4 34.46 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 176.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 3.5 mppt? -124.0 155.3 38.49 Favored 'General case' 0 C--N 1.292 -1.909 0 C-N-CA 119.689 -0.804 . . . . 0.0 111.125 175.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.646 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 19.3 m95 -90.53 176.01 6.85 Favored 'General case' 0 N--CA 1.418 -2.039 0 CA-C-N 114.548 -1.205 . . . . 0.0 108.522 -179.793 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.486 HD11 ' HB ' ' A' ' 40' ' ' THR . 49.8 pt -72.71 -15.48 17.57 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.491 0 N-CA-C 112.313 0.486 . . . . 0.0 112.313 -177.639 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.454 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 30.5 p-10 -88.11 -7.97 56.14 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 177.067 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 92.73 8.08 62.44 Favored Glycine 0 N--CA 1.444 -0.816 0 CA-C-N 114.771 -1.104 . . . . 0.0 113.766 178.14 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.4 t -81.09 167.82 19.31 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 117.323 0.562 . . . . 0.0 109.613 -179.082 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 8.1 m -90.46 139.68 30.45 Favored 'General case' 0 N--CA 1.431 -1.382 0 N-CA-C 109.273 -0.639 . . . . 0.0 109.273 178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.551 HD11 HD12 ' A' ' 92' ' ' ILE . 35.0 tp -55.18 138.99 43.48 Favored 'General case' 0 C--N 1.313 -0.992 0 CA-C-N 115.74 -0.663 . . . . 0.0 112.015 173.402 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.481 ' OD1' HG13 ' A' ' 89' ' ' VAL . 26.4 t-20 -98.29 91.46 5.24 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.302 -1.369 . . . . 0.0 107.302 170.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 39.5 p -71.88 -4.92 30.89 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-O 121.3 0.572 . . . . 0.0 111.849 -177.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -75.43 -18.13 59.99 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 115.485 -0.78 . . . . 0.0 111.555 -178.098 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.505 ' HA ' ' NE2' ' A' ' 47' ' ' GLN . 33.6 m -75.41 -55.47 11.44 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.511 0 C-N-CA 119.111 -1.036 . . . . 0.0 112.494 -177.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.514 HD12 HD13 ' A' ' 50' ' ' LEU . 87.0 mt -145.51 -177.8 5.75 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.014 0.435 . . . . 0.0 111.344 -172.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.561 ' O ' ' HB ' ' A' ' 109' ' ' VAL . 10.7 tptm -57.72 98.69 0.03 OUTLIER 'General case' 0 C--O 1.208 -1.093 0 C-N-CA 125.866 1.666 . . . . 0.0 112.182 176.725 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.551 HD12 HD11 ' A' ' 85' ' ' LEU . 4.8 mt -150.69 111.02 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.501 -0.911 0 N-CA-C 106.822 -1.548 . . . . 0.0 106.822 171.48 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.1 m -71.45 133.7 46.07 Favored 'General case' 0 C--N 1.291 -1.945 0 N-CA-C 107.386 -1.339 . . . . 0.0 107.386 177.509 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -83.81 -53.99 3.2 Favored Glycine 0 CA--C 1.47 -2.753 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -173.584 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -96.87 132.02 43.03 Favored 'General case' 0 N--CA 1.421 -1.894 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 8.9 t -152.25 -19.92 0.17 Allowed 'General case' 0 C--N 1.307 -1.269 0 C-N-CA 120.605 -0.438 . . . . 0.0 111.804 -177.402 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.52 ' HA ' HD11 ' A' ' 72' ' ' LEU . 5.8 mm-40 60.88 36.14 19.04 Favored 'General case' 0 C--O 1.243 0.763 0 C-N-CA 123.964 0.906 . . . . 0.0 113.377 178.228 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -117.47 171.73 7.8 Favored 'General case' 0 C--N 1.306 -1.304 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.693 -178.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 38.9 t70 -93.85 28.32 2.43 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 125.762 1.625 . . . . 0.0 108.021 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.401 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 66.8 m -84.11 155.73 22.49 Favored 'General case' 0 N--CA 1.422 -1.854 0 N-CA-C 116.048 1.87 . . . . 0.0 116.048 -169.358 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 84.0 m -131.63 149.33 52.53 Favored 'General case' 0 C--N 1.308 -1.235 0 N-CA-C 105.858 -1.904 . . . . 0.0 105.858 171.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -91.09 146.45 23.83 Favored 'General case' 0 C--N 1.307 -1.252 0 N-CA-C 112.652 0.612 . . . . 0.0 112.652 -173.166 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.48 144.84 32.16 Favored 'General case' 0 N--CA 1.433 -1.278 0 CA-C-N 115.03 -0.986 . . . . 0.0 109.588 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.612 ' O ' ' HA ' ' A' ' 63' ' ' SER . 7.7 mm -77.33 124.74 36.29 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.739 0 N-CA-C 107.118 -1.438 . . . . 0.0 107.118 177.033 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.479 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 23.3 t -94.07 -43.21 8.61 Favored 'General case' 0 N--CA 1.414 -2.233 0 N-CA-C 106.825 -1.546 . . . . 0.0 106.825 173.73 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . -168.52 -109.36 0.22 Allowed Glycine 0 N--CA 1.418 -2.563 0 N-CA-C 109.12 -1.592 . . . . 0.0 109.12 179.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -75.81 -19.16 59.16 Favored 'General case' 0 C--N 1.312 -1.034 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 177.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -110.89 154.47 24.0 Favored 'General case' 0 C--O 1.259 1.589 0 CA-C-N 115.239 -0.891 . . . . 0.0 110.201 -177.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.561 ' HB ' ' O ' ' A' ' 91' ' ' LYS . 23.6 t -106.0 130.03 58.21 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.66 0 N-CA-C 105.414 -2.069 . . . . 0.0 105.414 175.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.0 p -130.94 151.65 51.13 Favored 'General case' 0 C--N 1.27 -2.887 0 N-CA-C 108.256 -1.016 . . . . 0.0 108.256 -174.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.401 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 19.7 p90 -126.83 133.11 50.83 Favored 'General case' 0 C--N 1.282 -2.331 0 N-CA-C 112.767 0.655 . . . . 0.0 112.767 -173.749 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -129.46 174.51 9.57 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 179.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . 0.471 ' HB3' ' ND2' ' A' ' 115' ' ' ASN . 19.7 m -53.94 129.96 35.84 Favored 'General case' 0 C--N 1.308 -1.226 0 O-C-N 123.76 0.662 . . . . 0.0 109.224 174.355 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 9.2 m -58.87 -20.55 52.18 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 123.864 0.866 . . . . 0.0 112.33 -174.478 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . 0.471 ' ND2' ' HB3' ' A' ' 113' ' ' SER . 9.7 p30 -80.6 -9.08 59.8 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.291 -179.677 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 51.0 p -68.02 144.8 54.98 Favored 'General case' 0 N--CA 1.441 -0.894 0 C-N-CA 120.346 -0.541 . . . . 0.0 110.753 -177.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -80.84 89.32 5.83 Favored 'General case' 0 C--N 1.3 -1.57 0 CA-C-N 115.413 -0.812 . . . . 0.0 109.504 -176.452 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.549 ' OD1' ' HB2' ' A' ' 63' ' ' SER . 35.1 m-80 -125.92 170.48 11.63 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.449 -178.123 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.73 ' HB3' ' O ' ' A' ' 21' ' ' SER . 0.0 OUTLIER -89.82 179.6 5.95 Favored 'General case' 0 C--N 1.287 -2.117 0 N-CA-C 107.545 -1.279 . . . . 0.0 107.545 -178.304 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.411 ' CZ3' HG23 ' A' ' 23' ' ' VAL . 17.9 p90 -153.24 165.01 37.06 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 119.757 1.162 . . . . 0.0 112.201 -175.236 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.433 HD13 HD12 ' A' ' 53' ' ' LEU . 80.8 mt -120.18 127.31 75.89 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.856 0 CA-C-N 115.967 -0.561 . . . . 0.0 109.973 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 70.9 m -106.89 142.58 36.29 Favored 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.418 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.3 pt20 -124.18 135.93 53.82 Favored 'General case' 0 N--CA 1.417 -2.093 0 N-CA-C 108.209 -1.034 . . . . 0.0 108.209 171.816 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 26.3 ttmt -108.94 109.25 20.28 Favored 'General case' 0 C--N 1.254 -3.554 0 N-CA-C 105.411 -2.07 . . . . 0.0 105.411 174.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.487 ' O ' ' HB2' ' A' ' 128' ' ' HIS . 36.9 tt0 -68.62 124.4 23.5 Favored 'General case' 0 N--CA 1.414 -2.241 0 N-CA-C 104.499 -2.408 . . . . 0.0 104.499 174.082 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.709 HD13 ' SG ' ' A' ' 17' ' ' CYS . 6.8 tp -66.44 -22.39 66.22 Favored 'General case' 0 C--N 1.284 -2.261 0 CA-C-N 114.737 -1.12 . . . . 0.0 111.598 -166.428 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' TYR . . . . . 0.543 ' HE1' ' OD1' ' A' ' 15' ' ' ASP . 50.9 m-85 -101.27 92.2 4.85 Favored 'General case' 0 C--N 1.294 -1.806 0 N-CA-C 106.687 -1.597 . . . . 0.0 106.687 168.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . 0.487 ' HB2' ' O ' ' A' ' 125' ' ' GLU . 26.2 t-80 -128.53 19.15 6.27 Favored 'General case' 0 C--N 1.307 -1.251 0 CA-C-O 122.383 1.087 . . . . 0.0 108.837 -175.076 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -77.78 76.77 4.3 Favored 'General case' 0 N--CA 1.432 -1.338 0 CA-C-N 114.481 -1.236 . . . . 0.0 111.119 -176.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 8.1 m -88.84 -14.25 37.38 Favored 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 172.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 85.1 mt -133.36 141.1 47.75 Favored 'General case' 0 N--CA 1.427 -1.601 0 N-CA-C 105.069 -2.197 . . . . 0.0 105.069 176.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 32.0 t -84.35 -73.37 0.43 Allowed 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.138 -1.06 . . . . 0.0 108.138 177.428 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 86.9 m-20 -123.63 -52.68 1.8 Allowed 'General case' 0 C--N 1.312 -1.065 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 176.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -149.88 160.76 43.32 Favored 'General case' 0 N--CA 1.444 -0.742 0 CA-C-N 115.637 -0.71 . . . . 0.0 109.347 178.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 74.6 t -83.12 -38.56 14.67 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.032 0 CA-C-O 121.401 0.619 . . . . 0.0 110.978 178.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 91.2 -62.97 2.8 Favored Glycine 0 C--O 1.22 -0.724 0 N-CA-C 109.832 -1.307 . . . . 0.0 109.832 -176.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 72.0 m-85 -84.2 15.36 3.57 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 122.141 0.972 . . . . 0.0 110.638 175.186 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -129.29 11.0 6.14 Favored Glycine 0 N--CA 1.428 -1.852 0 N-CA-C 108.391 -1.884 . . . . 0.0 108.391 173.582 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 83.1 t60 . . . . . 0 C--O 1.244 0.8 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 -178.347 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 39.7 m . . . . . 0 N--CA 1.446 -0.661 0 CA-C-O 120.683 0.278 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -108.71 -179.83 3.98 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 107.961 -1.125 . . . . 0.0 107.961 175.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.533 ' HB2' ' O ' ' A' ' 14' ' ' ARG . 13.5 tppt? -123.57 -59.67 1.52 Allowed 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 122.011 0.91 . . . . 0.0 109.159 -177.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.581 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 5.0 mp -121.62 -176.86 3.41 Favored 'General case' 0 C--N 1.261 -3.239 0 N-CA-C 106.11 -1.811 . . . . 0.0 106.11 171.531 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -95.34 141.17 29.22 Favored 'General case' 0 C--N 1.304 -1.375 0 CA-C-O 121.583 0.706 . . . . 0.0 111.343 179.467 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . 0.485 ' HB3' HD11 ' A' ' 126' ' ' LEU . 14.6 p -125.95 170.76 8.9 Favored Pre-proline 0 C--N 1.29 -2.006 0 CA-C-N 114.751 -1.113 . . . . 0.0 109.026 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.647 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 52.3 Cg_exo -58.42 152.77 51.99 Favored 'Trans proline' 0 CA--C 1.549 1.245 0 C-N-CA 122.855 2.37 . . . . 0.0 112.487 179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -58.55 -31.63 68.14 Favored 'General case' 0 N--CA 1.475 0.809 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 -171.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -89.92 8.68 31.03 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-O 121.405 0.622 . . . . 0.0 110.641 -174.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.647 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 31.8 m95 -111.4 131.23 55.35 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.788 -0.642 . . . . 0.0 109.913 -176.51 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.479 ' O ' ' HA ' ' A' ' 17' ' ' CYS . 1.7 mm? -85.2 117.71 24.31 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -178.527 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.595 ' HA ' ' SG ' ' A' ' 17' ' ' CYS . 1.8 m -78.95 123.59 27.42 Favored 'General case' 0 C--N 1.287 -2.127 0 CA-C-N 115.145 -0.934 . . . . 0.0 110.96 -175.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 27.7 t-80 -145.29 114.11 6.86 Favored 'General case' 0 C--N 1.321 -0.662 0 O-C-N 122.019 -0.425 . . . . 0.0 110.044 178.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.533 ' O ' ' HB2' ' A' ' 3' ' ' LYS . 56.6 mtp180 71.02 -85.17 0.03 OUTLIER 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.31 1.044 . . . . 0.0 111.88 176.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -146.42 19.2 1.36 Allowed 'General case' 0 C--N 1.308 -1.209 0 C-N-CA 123.816 0.847 . . . . 0.0 109.98 -176.384 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.51 ' HG2' ' NE2' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -143.56 160.33 40.82 Favored 'General case' 0 CA--C 1.509 -0.606 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 175.961 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.595 ' SG ' ' HA ' ' A' ' 12' ' ' SER . 79.3 m -125.99 142.3 51.58 Favored 'General case' 0 C--N 1.291 -1.939 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 173.543 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 14.5 m-85 -110.8 144.04 40.41 Favored 'General case' 0 C--N 1.312 -1.058 0 CA-C-O 120.738 0.304 . . . . 0.0 111.684 -171.358 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 43.8 t-80 -123.25 109.07 13.5 Favored 'General case' 0 C--N 1.311 -1.089 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 176.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 57.7 t -83.92 91.94 2.86 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.379 0 N-CA-C 108.396 -0.964 . . . . 0.0 108.396 177.179 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.731 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 6.5 m -78.33 105.84 9.85 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 109.381 -0.6 . . . . 0.0 109.381 -178.77 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.536 HE22 ' ND2' ' A' ' 62' ' ' ASN . 12.3 mm100 -77.49 14.43 1.0 Allowed 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.47 1.108 . . . . 0.0 112.65 -179.367 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.536 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.0 m -108.62 157.92 8.66 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.932 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 178.783 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 49.4 m -106.84 156.77 18.33 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 115.085 1.513 . . . . 0.0 115.085 -171.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 33.4 m-20 -167.81 175.29 6.96 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 128.024 2.53 . . . . 0.0 107.948 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 77.1 p -82.01 176.61 9.4 Favored 'General case' 0 C--O 1.257 1.471 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 171.348 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 83.3 t90 -61.81 -50.86 70.62 Favored 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . 0.276 49.1 mt-10 -67.68 -30.62 70.19 Favored 'General case' 0 N--CA 1.45 -0.433 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -65.81 -49.26 68.89 Favored 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 119.818 -0.753 . . . . 0.0 110.965 172.756 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -61.85 -33.9 86.93 Favored Glycine 0 C--N 1.339 0.741 0 N-CA-C 111.522 -0.631 . . . . 0.0 111.522 178.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -55.33 -52.87 62.07 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.848 0.859 . . . . 0.0 108.992 176.173 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.48 -31.8 52.72 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-O 121.198 0.523 . . . . 0.0 111.019 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.441 ' O ' ' HD2' ' A' ' 37' ' ' LYS . 1.0 OUTLIER -62.46 -36.38 82.27 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 116.352 -0.386 . . . . 0.0 111.487 176.625 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 73.3 m -68.1 -41.09 82.32 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 175.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -57.36 -35.92 70.56 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 121.413 0.625 . . . . 0.0 109.622 176.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -63.08 -14.54 53.63 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-N 115.013 -0.994 . . . . 0.0 114.061 178.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.441 ' HD2' ' O ' ' A' ' 33' ' ' ASP . 3.3 mptp? -108.36 3.54 23.49 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 117.622 0.711 . . . . 0.0 110.644 176.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.87 28.79 66.2 Favored Glycine 0 N--CA 1.452 -0.298 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -174.63 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -118.51 176.84 5.06 Favored 'General case' 0 N--CA 1.431 -1.393 0 C-N-CA 124.261 1.024 . . . . 0.0 108.705 -175.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -123.52 149.69 44.9 Favored 'General case' 0 C--N 1.289 -2.064 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.9 tp -65.56 125.57 25.61 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 107.916 -1.142 . . . . 0.0 107.916 177.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.4 tpt -26.62 121.98 0.08 Allowed 'General case' 0 N--CA 1.501 2.082 0 N-CA-C 116.732 2.123 . . . . 0.0 116.732 -169.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.441 HD12 ' HB3' ' A' ' 79' ' ' TRP . 2.8 mm? -112.16 105.27 13.57 Favored 'General case' 0 C--O 1.238 0.463 0 C-N-CA 124.927 1.291 . . . . 0.0 107.599 178.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.481 HD13 HD11 ' A' ' 50' ' ' LEU . 56.5 mt -85.3 117.94 31.29 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.478 0 CA-C-N 116.471 -0.331 . . . . 0.0 110.134 -175.677 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 14.5 mm100 -82.5 -54.49 5.15 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-O 121.265 0.555 . . . . 0.0 111.404 179.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.583 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 17.1 m-20 -137.04 -179.02 5.46 Favored 'General case' 0 CA--C 1.508 -0.653 0 O-C-N 122.119 -0.363 . . . . 0.0 111.072 -171.086 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.62 -39.63 80.72 Favored 'General case' 0 CA--C 1.538 0.517 0 N-CA-C 108.218 -1.031 . . . . 0.0 108.218 -178.365 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -58.71 -28.26 65.65 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.167 -0.924 . . . . 0.0 111.792 179.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.583 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 6.5 mm-40 -60.21 -55.18 36.9 Favored 'General case' 0 C--O 1.219 -0.532 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 175.479 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.638 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 46.3 mt -68.85 -26.09 64.97 Favored 'General case' 0 C--O 1.202 -1.424 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 -177.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -64.25 -38.32 90.63 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 120.308 -0.557 . . . . 0.0 109.694 174.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -73.1 -28.5 62.32 Favored 'General case' 0 N--CA 1.439 -0.983 0 N-CA-C 108.805 -0.813 . . . . 0.0 108.805 177.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.63 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.3 mm? -66.22 -51.89 53.2 Favored 'General case' 0 C--O 1.183 -2.425 0 N-CA-C 109.423 -0.584 . . . . 0.0 109.423 174.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.638 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 50.9 mt -54.8 -33.36 61.39 Favored 'General case' 0 C--N 1.312 -1.06 0 N-CA-C 112.32 0.489 . . . . 0.0 112.32 -176.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -72.89 -46.21 53.98 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.147 -0.479 . . . . 0.0 111.543 174.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 26.3 p -75.53 -27.04 58.54 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-O 121.127 0.489 . . . . 0.0 111.831 -174.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.63 HG12 ' O ' ' A' ' 53' ' ' LEU . 34.2 mm -58.7 -48.92 84.44 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.778 0 CA-C-N 115.332 -0.849 . . . . 0.0 109.243 174.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.5 tppt? 67.99 -66.41 0.22 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.037 0.935 . . . . 0.0 112.667 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -62.01 -51.28 68.67 Favored 'General case' 0 C--O 1.207 -1.142 0 C-N-CA 123.842 0.857 . . . . 0.0 111.131 -176.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.51 ' H ' HG22 ' A' ' 57' ' ' ILE . 3.8 ttmp? 71.31 -40.85 0.49 Allowed 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 115.133 1.531 . . . . 0.0 115.133 172.468 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 39.9 m-85 -80.81 37.68 0.43 Allowed 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.787 0.803 . . . . 0.0 112.911 -174.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.607 ' O ' ' HA ' ' A' ' 105' ' ' SER . 54.2 m-80 -124.97 -158.88 0.85 Allowed 'General case' 0 C--N 1.29 -1.998 0 N-CA-C 106.288 -1.745 . . . . 0.0 106.288 176.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.46 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 15.3 m -143.28 117.82 9.75 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 178.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.521 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 2.2 m-85 -122.56 117.5 26.03 Favored 'General case' 0 C--N 1.313 -0.982 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 -176.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 75.2 m95 -63.15 139.77 58.81 Favored 'General case' 0 C--N 1.309 -1.194 0 C-N-CA 123.063 0.545 . . . . 0.0 111.428 179.82 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -117.76 172.76 5.09 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.1 0 N-CA-C 106.445 -1.687 . . . . 0.0 106.445 168.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.59 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -74.92 44.09 1.5 Allowed Glycine 0 C--O 1.216 -1.01 0 CA-C-N 119.132 0.878 . . . . 0.0 114.544 -174.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.509 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 28.8 mt -114.37 123.68 50.07 Favored 'General case' 0 CA--C 1.483 -1.614 0 C-N-CA 123.793 0.837 . . . . 0.0 111.898 -178.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -142.52 140.69 31.91 Favored 'General case' 0 C--N 1.299 -1.619 0 C-N-CA 120.086 -0.645 . . . . 0.0 110.076 171.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.558 ' HD2' ' O ' ' A' ' 98' ' ' ASN . 82.9 t80 -83.02 113.21 20.43 Favored 'General case' 0 N--CA 1.428 -1.525 0 N-CA-C 106.16 -1.793 . . . . 0.0 106.16 177.95 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.447 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 32.5 p -102.38 132.93 48.06 Favored 'General case' 0 C--N 1.283 -2.284 0 C-N-CA 119.856 -0.738 . . . . 0.0 112.325 -173.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 77.6 mt -120.58 140.17 30.01 Favored Pre-proline 0 N--CA 1.428 -1.526 0 CA-C-N 115.826 -0.624 . . . . 0.0 109.899 174.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 8.5 Cg_endo -86.81 132.76 14.06 Favored 'Cis proline' 0 N--CA 1.452 -0.932 0 C-N-CA 123.298 -1.542 . . . . 0.0 110.757 -3.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.447 ' HB3' ' O ' ' A' ' 71' ' ' THR . 11.6 t70 178.46 -42.8 0.01 OUTLIER 'General case' 0 C--N 1.311 -1.074 0 N-CA-C 106.003 -1.851 . . . . 0.0 106.003 -174.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 4.4 mpp? 65.27 17.28 10.94 Favored 'General case' 0 C--O 1.241 0.625 0 CA-C-N 113.619 -1.628 . . . . 0.0 114.258 176.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -122.47 158.22 30.26 Favored 'General case' 0 C--N 1.303 -1.446 0 CA-C-O 121.26 0.552 . . . . 0.0 110.789 174.337 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.507 ' HE1' ' HA2' ' A' ' 94' ' ' GLY . 83.0 m95 -88.92 112.71 23.63 Favored 'General case' 0 N--CA 1.427 -1.586 0 N-CA-C 106.933 -1.506 . . . . 0.0 106.933 173.513 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -116.86 154.64 30.41 Favored 'General case' 0 C--N 1.278 -2.504 0 C-N-CA 120.323 -0.551 . . . . 0.0 110.922 -176.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.59 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 47.2 m95 -98.55 165.5 11.79 Favored 'General case' 0 N--CA 1.425 -1.722 0 CA-C-N 114.504 -1.225 . . . . 0.0 109.353 179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 49.1 pt -73.28 -13.76 16.35 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.063 -179.047 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 29.4 p-10 -92.61 -0.66 57.28 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.396 0.617 . . . . 0.0 109.844 -178.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 99.46 -2.72 57.59 Favored Glycine 0 N--CA 1.439 -1.117 0 CA-C-N 115.016 -0.993 . . . . 0.0 114.256 176.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.1 t -84.82 170.6 13.01 Favored 'General case' 0 C--O 1.246 0.908 0 CA-C-N 117.609 0.705 . . . . 0.0 109.852 -178.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 26.3 m -112.15 145.49 39.72 Favored 'General case' 0 N--CA 1.419 -2.004 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 175.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.448 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 43.0 tp -53.86 131.98 40.87 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 114.827 1.418 . . . . 0.0 114.827 -178.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -86.51 87.85 7.52 Favored 'General case' 0 N--CA 1.434 -1.262 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 168.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.2 m -64.18 -10.88 25.82 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.134 -0.939 . . . . 0.0 111.923 -177.117 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -77.72 -6.56 54.41 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 113.162 0.801 . . . . 0.0 113.162 -178.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 22.6 m -74.32 -48.96 34.3 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.685 0 C-N-CA 118.764 -1.174 . . . . 0.0 111.924 -179.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.2 mt -156.72 -178.09 7.09 Favored 'General case' 0 CA--C 1.497 -1.092 0 N-CA-C 106.929 -1.508 . . . . 0.0 106.929 -175.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -73.49 123.31 23.67 Favored 'General case' 0 C--N 1.302 -1.463 0 N-CA-C 113.077 0.769 . . . . 0.0 113.077 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 4.0 mt -142.59 132.33 22.6 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.058 0 N-CA-C 105.721 -1.955 . . . . 0.0 105.721 171.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 18.2 m -112.71 131.94 55.43 Favored 'General case' 0 C--N 1.288 -2.083 0 C-N-CA 120.89 -0.324 . . . . 0.0 110.192 -173.633 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.507 ' HA2' ' HE1' ' A' ' 77' ' ' TRP . . . -91.87 -14.46 56.44 Favored Glycine 0 N--CA 1.426 -2.028 0 N-CA-C 110.094 -1.203 . . . . 0.0 110.094 179.009 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -77.25 111.16 12.6 Favored 'General case' 0 N--CA 1.43 -1.454 0 N-CA-C 107.957 -1.127 . . . . 0.0 107.957 174.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 98' ' ' ASN . 5.5 t -171.32 -42.86 0.02 OUTLIER 'General case' 0 C--N 1.274 -2.674 0 CA-C-N 114.473 -1.239 . . . . 0.0 108.43 -175.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 68.09 19.06 9.34 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 125.145 1.378 . . . . 0.0 111.373 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.558 ' O ' ' HD2' ' A' ' 70' ' ' TYR . 26.3 m-80 -121.71 152.9 38.9 Favored 'General case' 0 CA--C 1.498 -1.048 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 178.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 12.1 t70 -72.16 30.46 0.05 Allowed 'General case' 0 N--CA 1.497 1.909 0 C-N-CA 126.346 1.858 . . . . 0.0 110.527 -179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.452 ' H ' ' C ' ' A' ' 98' ' ' ASN . 41.0 t -62.36 149.07 43.35 Favored 'General case' 0 C--N 1.311 -1.098 0 C-N-CA 126.14 1.776 . . . . 0.0 112.802 -172.186 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 90.1 m -112.92 145.31 40.97 Favored 'General case' 0 N--CA 1.443 -0.824 0 CA-C-N 115.067 -0.969 . . . . 0.0 108.794 178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.481 ' HB1' HG12 ' A' ' 109' ' ' VAL . . . -98.0 147.2 24.74 Favored 'General case' 0 C--O 1.255 1.364 0 CA-C-O 121.3 0.571 . . . . 0.0 111.898 -176.396 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -139.53 152.21 46.74 Favored 'General case' 0 N--CA 1.44 -0.936 0 CA-C-N 115.441 -0.8 . . . . 0.0 110.486 -179.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.46 ' O ' ' HA ' ' A' ' 63' ' ' SER . 17.3 mm -77.85 112.53 15.92 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.458 0 N-CA-C 105.388 -2.079 . . . . 0.0 105.388 172.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.607 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 8.5 t -131.82 33.53 3.96 Favored 'General case' 0 C--N 1.286 -2.154 0 CA-C-O 122.376 1.084 . . . . 0.0 108.511 -177.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 157.66 -139.82 6.65 Favored Glycine 0 N--CA 1.412 -2.913 0 N-CA-C 108.277 -1.929 . . . . 0.0 108.277 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.433 ' OD2' ' HE3' ' A' ' 108' ' ' LYS . 14.2 p-10 -98.99 8.82 44.64 Favored 'General case' 0 C--N 1.29 -2.017 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.363 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.433 ' HE3' ' OD2' ' A' ' 107' ' ' ASP . 32.4 mmtp -130.43 163.65 26.46 Favored 'General case' 0 N--CA 1.436 -1.152 0 CA-C-N 114.753 -1.112 . . . . 0.0 108.102 179.924 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.481 HG12 ' HB1' ' A' ' 102' ' ' ALA . 2.8 t -99.11 119.83 47.63 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.539 0 N-CA-C 106.782 -1.562 . . . . 0.0 106.782 179.697 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 63.1 p -122.04 143.78 49.3 Favored 'General case' 0 C--N 1.287 -2.111 0 N-CA-C 108.301 -1.0 . . . . 0.0 108.301 -176.569 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.41 ' HA ' ' HA ' ' A' ' 102' ' ' ALA . 23.6 p90 -109.67 145.86 35.8 Favored 'General case' 0 C--N 1.291 -1.963 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -173.082 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -135.76 175.43 9.6 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.79 -1.096 . . . . 0.0 109.942 -179.013 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 14.3 m -67.57 127.06 31.33 Favored 'General case' 0 N--CA 1.413 -2.305 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 171.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 20.5 m -56.33 -21.79 26.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.465 0.706 . . . . 0.0 112.585 -173.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -77.15 -3.46 39.59 Favored 'General case' 0 C--N 1.313 -0.986 0 N-CA-C 113.304 0.854 . . . . 0.0 113.304 -179.508 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 30.6 p -75.97 140.39 42.02 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-N 119.316 0.962 . . . . 0.0 111.389 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 27.6 t70 -83.58 89.1 7.05 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-O 121.546 0.689 . . . . 0.0 109.444 -177.011 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -120.78 174.38 6.63 Favored 'General case' 0 C--O 1.196 -1.759 0 C-N-CA 124.563 1.145 . . . . 0.0 109.832 -177.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.731 ' HB3' ' O ' ' A' ' 21' ' ' SER . 3.4 mpt_? -85.87 -178.77 6.67 Favored 'General case' 0 C--N 1.293 -1.873 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -176.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 24.8 p90 -153.18 162.77 40.93 Favored 'General case' 0 C--N 1.321 -0.661 0 C-N-CA 118.688 -1.205 . . . . 0.0 111.999 -176.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 75.6 mt -120.13 125.57 74.37 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.903 0 CA-C-O 121.237 0.542 . . . . 0.0 109.856 178.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 71.7 m -105.24 145.25 30.9 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 108.275 -1.009 . . . . 0.0 108.275 176.538 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.51 ' NE2' ' HG2' ' A' ' 16' ' ' LYS . 8.7 pt20 -122.61 133.5 54.54 Favored 'General case' 0 N--CA 1.412 -2.326 0 N-CA-C 107.247 -1.39 . . . . 0.0 107.247 171.258 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 26.8 ttpt -110.66 108.0 17.76 Favored 'General case' 0 N--CA 1.397 -3.124 0 N-CA-C 107.079 -1.452 . . . . 0.0 107.079 173.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.462 ' HA ' ' HA ' ' A' ' 16' ' ' LYS . 42.3 tt0 -68.74 134.43 49.77 Favored 'General case' 0 N--CA 1.419 -1.999 0 CA-C-N 113.989 -1.459 . . . . 0.0 108.365 -177.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.581 ' HG ' ' H ' ' A' ' 4' ' ' LEU . 1.7 mm? -67.37 -27.38 67.06 Favored 'General case' 0 C--N 1.31 -1.11 0 CA-C-O 121.782 0.801 . . . . 0.0 109.404 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' TYR . . . . . 0.439 ' H ' ' HG2' ' A' ' 125' ' ' GLU . 10.7 m-85 -89.1 21.9 3.0 Favored 'General case' 0 C--N 1.305 -1.354 0 CA-C-N 114.498 -1.228 . . . . 0.0 111.853 177.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -70.67 -6.66 38.71 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 23.7 mm-40 -54.65 108.9 0.43 Allowed 'General case' 0 N--CA 1.44 -0.933 0 CA-C-N 114.577 -1.192 . . . . 0.0 107.988 175.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 6.7 m -89.18 154.87 19.8 Favored 'General case' 0 C--N 1.28 -2.432 0 N-CA-C 107.943 -1.132 . . . . 0.0 107.943 -178.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -63.88 -35.25 80.02 Favored 'General case' 0 CA--C 1.512 -0.495 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 177.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 18.0 m -124.14 96.35 4.89 Favored 'General case' 0 N--CA 1.422 -1.849 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 173.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 43.7 m-80 -86.49 70.36 10.45 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 -179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 14.3 t80 -174.86 161.82 3.1 Favored 'General case' 0 C--N 1.306 -1.322 0 N-CA-C 105.271 -2.122 . . . . 0.0 105.271 -174.438 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 57.6 t -71.59 -39.3 69.75 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 177.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 95.41 -11.12 69.05 Favored Glycine 0 CA--C 1.504 -0.651 0 N-CA-C 115.122 0.809 . . . . 0.0 115.122 168.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 55.8 m-85 60.42 17.55 7.32 Favored 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 123.702 0.801 . . . . 0.0 110.507 -178.241 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 137.38 -30.33 2.62 Favored Glycine 0 N--CA 1.43 -1.763 0 CA-C-N 115.846 -0.616 . . . . 0.0 111.909 -176.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 . . . . . 0 C--N 1.308 -1.238 0 O-C-N 122.353 -0.498 . . . . 0.0 110.025 -179.719 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.7 m . . . . . 0 C--O 1.236 0.344 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 66.63 110.81 0.04 OUTLIER 'General case' 0 C--N 1.349 0.583 0 C-N-CA 124.091 0.957 . . . . 0.0 109.631 -175.155 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 2.2 tmpt? 71.62 131.45 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.719 0 CA-C-O 122.417 1.103 . . . . 0.0 112.487 -173.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.584 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 5.0 mp -100.04 179.38 4.51 Favored 'General case' 0 C--N 1.289 -2.032 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 175.648 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -80.67 140.52 35.6 Favored 'General case' 0 C--N 1.29 -2.003 0 CA-C-O 121.766 0.793 . . . . 0.0 112.583 -176.443 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 18.8 p -128.18 165.92 27.52 Favored Pre-proline 0 C--N 1.296 -1.759 0 CA-C-N 114.985 -1.007 . . . . 0.0 109.517 -179.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.695 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 52.4 Cg_exo -54.08 162.16 4.34 Favored 'Trans proline' 0 C--N 1.373 1.826 0 C-N-CA 123.222 2.615 . . . . 0.0 115.084 -178.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -59.78 -35.49 74.75 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 115.212 1.56 . . . . 0.0 115.212 -173.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -89.7 3.08 53.85 Favored 'General case' 0 N--CA 1.48 1.052 0 N-CA-C 112.405 0.52 . . . . 0.0 112.405 -175.215 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.695 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 16.9 m95 -101.11 153.11 19.86 Favored 'General case' 0 C--N 1.292 -1.931 0 C-N-CA 121.019 -0.272 . . . . 0.0 111.628 -171.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -108.38 124.4 50.31 Favored 'General case' 0 N--CA 1.469 0.504 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 -179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 59.8 p -90.82 126.61 36.08 Favored 'General case' 0 C--N 1.291 -1.954 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -176.098 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.463 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 54.1 t-80 -146.21 115.13 6.93 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 123.002 0.521 . . . . 0.0 110.086 179.371 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . 0.25 3.9 mpt_? 53.58 59.14 4.53 Favored 'General case' 0 C--N 1.316 -0.848 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 174.628 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . 0.523 ' HB3' ' CD1' ' A' ' 127' ' ' TYR . 10.5 m-20 62.65 24.83 14.78 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.169 -0.923 . . . . 0.0 111.446 174.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 17.3 mtpp -145.67 148.01 32.6 Favored 'General case' 0 C--N 1.318 -0.763 0 N-CA-C 105.543 -2.021 . . . . 0.0 105.543 -179.528 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.407 ' SG ' ' HB3' ' A' ' 10' ' ' TRP . 7.3 t -130.78 134.48 46.9 Favored 'General case' 0 C--N 1.291 -1.969 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 -176.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.463 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 11.8 m-85 -111.77 149.87 31.09 Favored 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 112.722 0.638 . . . . 0.0 112.722 -170.765 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.512 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 45.3 t-80 -129.52 116.94 19.68 Favored 'General case' 0 C--N 1.308 -1.205 0 N-CA-C 108.2 -1.037 . . . . 0.0 108.2 172.619 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.1 t -86.01 93.57 3.87 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.794 0 N-CA-C 106.972 -1.492 . . . . 0.0 106.972 174.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.726 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 13.3 m -77.8 107.76 10.54 Favored 'General case' 0 N--CA 1.416 -2.159 0 CA-C-N 115.306 -0.861 . . . . 0.0 108.696 -178.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.439 HE22 ' ND2' ' A' ' 62' ' ' ASN . 11.5 mm100 -83.55 13.92 4.17 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.603 0.716 . . . . 0.0 111.15 -179.714 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.478 HG23 ' CH2' ' A' ' 120' ' ' TRP . 5.7 m -100.62 158.32 3.99 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.149 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . 0.406 ' HA ' ' O ' ' A' ' 118' ' ' ASN . 13.2 m -109.97 151.59 26.93 Favored 'General case' 0 C--N 1.294 -1.81 0 C-N-CA 118.776 -1.17 . . . . 0.0 114.091 -171.034 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 33.8 m-20 -167.09 174.66 8.11 Favored 'General case' 0 CA--C 1.511 -0.536 0 C-N-CA 127.39 2.276 . . . . 0.0 108.426 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 31.5 p -86.37 171.89 10.83 Favored 'General case' 0 N--CA 1.43 -1.46 0 N-CA-C 107.443 -1.318 . . . . 0.0 107.443 170.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -56.54 -52.99 62.68 Favored 'General case' 0 C--N 1.318 -0.792 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -174.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.52 -31.26 70.38 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-O 120.956 0.408 . . . . 0.0 111.779 -175.609 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -70.23 -45.25 66.89 Favored 'General case' 0 N--CA 1.427 -1.607 0 CA-C-N 115.604 -0.725 . . . . 0.0 109.888 -179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.88 -32.04 82.83 Favored Glycine 0 C--N 1.341 0.824 0 N-CA-C 111.414 -0.674 . . . . 0.0 111.414 177.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.403 ' HA ' ' HB2' ' A' ' 41' ' ' LEU . 5.0 tt -56.42 -51.21 69.24 Favored 'General case' 0 C--O 1.242 0.682 0 N-CA-C 108.332 -0.988 . . . . 0.0 108.332 176.234 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 48.1 t -67.8 -33.24 60.41 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.839 -178.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -60.11 -37.06 78.87 Favored 'General case' 0 CA--C 1.502 -0.873 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 174.116 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 82.9 m -65.32 -42.35 93.07 Favored 'General case' 0 C--N 1.315 -0.917 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 27.6 m-20 -61.16 -27.73 68.61 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 116.087 -0.506 . . . . 0.0 110.194 177.122 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -58.64 -34.98 78.89 Favored Glycine 0 N--CA 1.449 -0.462 0 CA-C-N 115.77 -0.65 . . . . 0.0 112.576 177.49 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.2 mptp? -95.73 8.93 42.09 Favored 'General case' 0 C--N 1.323 -0.569 0 O-C-N 122.26 -0.553 . . . . 0.0 109.704 177.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 65.8 43.67 93.58 Favored Glycine 0 CA--C 1.503 -0.68 0 N-CA-C 109.695 -1.362 . . . . 0.0 109.695 -175.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -130.05 174.91 9.33 Favored 'General case' 0 N--CA 1.422 -1.848 0 N-CA-C 107.516 -1.29 . . . . 0.0 107.516 -177.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -119.29 150.83 39.47 Favored 'General case' 0 C--N 1.294 -1.834 0 CA-C-N 118.454 0.57 . . . . 0.0 110.972 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.403 ' HB2' ' HA ' ' A' ' 31' ' ' LEU . 25.9 tp -65.6 124.74 23.17 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 175.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.1 tpt -29.98 120.01 0.17 Allowed 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 116.986 2.217 . . . . 0.0 116.986 -169.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.404 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 2.9 mm? -109.3 110.6 21.82 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 114.191 -1.368 . . . . 0.0 107.505 176.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.9 mt -96.96 117.66 41.93 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 -175.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.401 HE22 ' HB3' ' A' ' 43' ' ' LEU . 2.1 mp0 -100.2 -25.1 14.38 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 111.835 0.309 . . . . 0.0 111.835 179.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -137.05 160.42 39.01 Favored 'General case' 0 CA--C 1.5 -0.973 0 CA-C-O 120.669 0.271 . . . . 0.0 110.77 -175.085 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -33.97 74.93 Favored 'General case' 0 C--N 1.322 -0.614 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 177.282 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 17.3 mp0 -58.6 -29.39 66.42 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.745 -1.116 . . . . 0.0 111.04 178.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 62.9 mm-40 -62.17 -54.45 40.86 Favored 'General case' 0 CA--C 1.51 -0.575 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 176.296 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.647 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 58.1 mt -65.28 -26.01 67.9 Favored 'General case' 0 C--O 1.21 -1.008 0 N-CA-C 113.214 0.82 . . . . 0.0 113.214 -178.355 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 17.8 mmt180 -62.9 -41.6 99.49 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 174.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.8 t80 -72.45 -28.06 62.7 Favored 'General case' 0 N--CA 1.441 -0.9 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 177.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.611 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -64.11 -50.75 67.03 Favored 'General case' 0 C--O 1.18 -2.603 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 175.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.647 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 51.1 mt -54.86 -35.18 63.74 Favored 'General case' 0 C--N 1.308 -1.206 0 C-N-CA 122.878 0.471 . . . . 0.0 111.974 -178.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -70.04 -42.34 73.02 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.296 -0.411 . . . . 0.0 112.102 175.18 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 13.6 p -81.63 -26.43 34.82 Favored 'General case' 0 C--N 1.319 -0.742 0 CA-C-O 121.204 0.526 . . . . 0.0 112.283 -176.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.611 HG12 ' O ' ' A' ' 53' ' ' LEU . 35.4 mm -64.08 -47.36 90.56 Favored 'Isoleucine or valine' 0 C--O 1.241 0.628 0 N-CA-C 108.653 -0.869 . . . . 0.0 108.653 174.261 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 56.1 tptt 67.1 -68.98 0.14 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.689 1.196 . . . . 0.0 112.62 179.572 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -65.48 -47.59 75.55 Favored 'General case' 0 C--O 1.213 -0.838 0 N-CA-C 112.77 0.655 . . . . 0.0 112.77 -175.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.475 ' H ' HG22 ' A' ' 57' ' ' ILE . 96.0 mttt 75.17 -39.28 0.4 Allowed 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.639 1.176 . . . . 0.0 113.923 177.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 70.3 m-85 -73.29 37.84 0.09 Allowed 'General case' 0 N--CA 1.482 1.164 0 N-CA-C 114.886 1.439 . . . . 0.0 114.886 -173.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.575 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 60.9 m-80 -128.0 -163.1 1.23 Allowed 'General case' 0 C--N 1.277 -2.578 0 N-CA-C 106.01 -1.848 . . . . 0.0 106.01 174.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.618 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 50.3 m -139.16 119.54 13.81 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 176.302 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.575 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 6.2 m-85 -120.91 116.17 24.62 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 109.579 -0.526 . . . . 0.0 109.579 -177.01 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.425 ' N ' ' HA ' ' A' ' 120' ' ' TRP . 71.5 m95 -61.81 138.85 58.37 Favored 'General case' 0 C--N 1.311 -1.091 0 C-N-CA 123.596 0.758 . . . . 0.0 111.492 179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.14 175.63 4.68 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.149 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 168.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.645 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.04 47.96 2.33 Favored Glycine 0 C--O 1.209 -1.438 0 C-N-CA 120.784 -0.722 . . . . 0.0 114.375 -174.994 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 33.7 mt -114.25 121.72 44.57 Favored 'General case' 0 C--N 1.309 -1.169 0 C-N-CA 123.283 0.633 . . . . 0.0 111.843 -179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 28.8 ptt180 -129.4 134.29 47.79 Favored 'General case' 0 C--N 1.302 -1.494 0 CA-C-N 115.041 -0.981 . . . . 0.0 109.226 179.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 30.6 t80 -87.39 112.82 22.52 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 179.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.516 ' OG1' ' HE2' ' A' ' 78' ' ' LYS . 46.6 p -99.44 121.11 40.67 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-N 115.998 -0.546 . . . . 0.0 112.128 -172.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.408 HD11 ' HA ' ' A' ' 97' ' ' GLU . 63.4 mt -120.75 146.26 43.13 Favored Pre-proline 0 C--N 1.303 -1.417 0 CA-C-N 116.101 -0.499 . . . . 0.0 110.731 176.725 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -85.25 126.16 9.74 Favored 'Cis proline' 0 C--O 1.242 0.701 0 C-N-CA 123.582 -1.424 . . . . 0.0 110.976 -3.554 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 21.9 t70 179.03 -46.38 0.01 OUTLIER 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 107.835 -1.172 . . . . 0.0 107.835 -177.381 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 46.5 mtm 71.73 8.25 6.08 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 125.347 1.459 . . . . 0.0 113.755 178.006 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -95.93 146.67 24.41 Favored 'General case' 0 C--N 1.295 -1.782 0 C-N-CA 118.988 -1.085 . . . . 0.0 109.173 173.639 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.405 ' HE1' ' HA2' ' A' ' 94' ' ' GLY . 77.5 m95 -86.93 119.93 27.67 Favored 'General case' 0 C--N 1.289 -2.051 0 N-CA-C 108.407 -0.96 . . . . 0.0 108.407 175.305 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.516 ' HE2' ' OG1' ' A' ' 71' ' ' THR . 55.9 mttm -113.22 152.29 29.94 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 108.894 -0.78 . . . . 0.0 108.894 -177.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.645 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 42.5 m95 -98.03 175.91 5.95 Favored 'General case' 0 C--N 1.288 -2.094 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 46.0 pt -71.93 -23.2 21.83 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 CA-C-O 120.95 0.405 . . . . 0.0 111.334 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . . . . . . . . . 32.3 p-10 -85.69 -9.68 56.83 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-O 121.628 0.728 . . . . 0.0 109.69 179.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 104.21 -0.08 44.11 Favored Glycine 0 CA--C 1.495 -1.18 0 CA-C-N 115.39 -0.823 . . . . 0.0 112.382 172.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 59.1 m -69.8 168.22 15.56 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 28.8 m -108.94 134.43 51.61 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 115.541 -0.754 . . . . 0.0 109.622 178.455 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.496 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 44.3 tp -54.45 142.27 27.85 Favored 'General case' 0 C--N 1.315 -0.928 0 C-N-CA 124.84 1.256 . . . . 0.0 114.047 179.444 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 26.3 t-20 -96.12 97.1 9.3 Favored 'General case' 0 N--CA 1.432 -1.335 0 N-CA-C 106.393 -1.706 . . . . 0.0 106.393 169.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 12.1 m -70.65 -6.11 34.53 Favored 'General case' 0 C--N 1.308 -1.209 0 CA-C-O 121.222 0.534 . . . . 0.0 111.328 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 27.9 m-20 -78.3 -6.21 54.39 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 116.214 -0.448 . . . . 0.0 112.079 -178.923 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.3 m -78.74 -54.47 11.85 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.31 0 C-N-CA 119.364 -0.934 . . . . 0.0 112.195 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 91.5 mt -157.37 -178.16 7.14 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.577 0.751 . . . . 0.0 109.188 -174.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.6 98.47 0.37 Allowed 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 115.239 1.57 . . . . 0.0 115.239 -177.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.406 HD12 HD11 ' A' ' 85' ' ' LEU . 8.8 mt -139.23 103.54 1.93 Allowed 'Isoleucine or valine' 0 C--N 1.297 -1.714 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 173.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.491 HG22 ' H ' ' A' ' 95' ' ' ASP . 9.7 m -76.05 132.31 40.03 Favored 'General case' 0 C--N 1.299 -1.604 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.086 -178.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . 0.405 ' HA2' ' HE1' ' A' ' 77' ' ' TRP . . . -106.26 12.61 44.14 Favored Glycine 0 CA--C 1.489 -1.559 0 N-CA-C 110.993 -0.843 . . . . 0.0 110.993 -177.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.491 ' H ' HG22 ' A' ' 93' ' ' THR . 7.2 p-10 -140.97 96.73 3.05 Favored 'General case' 0 C--N 1.285 -2.219 0 CA-C-O 121.557 0.694 . . . . 0.0 109.64 176.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.1 t -148.43 -20.48 0.33 Allowed 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.396 -176.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.408 ' HA ' HD11 ' A' ' 72' ' ' LEU . 6.3 mm-40 56.81 82.08 0.12 Allowed 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 123.983 0.913 . . . . 0.0 112.888 -177.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 44.1 m-80 -157.0 178.06 10.8 Favored 'General case' 0 C--N 1.308 -1.221 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 -178.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 26.3 t70 -108.83 26.17 10.89 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-O 123.137 1.446 . . . . 0.0 107.475 179.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.451 ' HB3' ' HB2' ' A' ' 111' ' ' PHE . 19.1 m -66.75 153.42 43.33 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -173.876 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -132.88 145.71 51.17 Favored 'General case' 0 C--N 1.297 -1.695 0 CA-C-N 113.606 -1.634 . . . . 0.0 107.0 173.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -92.16 148.24 22.31 Favored 'General case' 0 C--N 1.306 -1.289 0 N-CA-C 113.488 0.922 . . . . 0.0 113.488 -171.059 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.49 153.32 42.5 Favored 'General case' 0 N--CA 1.43 -1.426 0 CA-C-N 114.318 -1.31 . . . . 0.0 109.48 -179.27 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.618 ' O ' ' HA ' ' A' ' 63' ' ' SER . 14.2 mm -77.7 120.14 27.75 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.636 0 N-CA-C 107.445 -1.317 . . . . 0.0 107.445 174.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 34.1 t -134.97 94.21 3.12 Favored 'General case' 0 N--CA 1.421 -1.881 0 N-CA-C 108.269 -1.011 . . . . 0.0 108.269 178.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 88.24 -126.41 8.09 Favored Glycine 0 N--CA 1.429 -1.825 0 N-CA-C 110.255 -1.138 . . . . 0.0 110.255 179.676 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -102.3 8.39 40.38 Favored 'General case' 0 C--N 1.303 -1.447 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 177.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 33.3 mmtp -126.74 166.83 16.66 Favored 'General case' 0 N--CA 1.429 -1.523 0 CA-C-N 115.383 -0.826 . . . . 0.0 110.263 -173.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 3.6 t -104.85 133.51 48.82 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.753 0 N-CA-C 104.766 -2.309 . . . . 0.0 104.766 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 43.2 p -127.98 170.47 12.83 Favored 'General case' 0 C--N 1.278 -2.501 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 179.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.451 ' HB2' ' HB3' ' A' ' 100' ' ' SER . 11.3 p90 -130.35 125.28 34.23 Favored 'General case' 0 C--N 1.296 -1.758 0 C-N-CA 119.619 -0.832 . . . . 0.0 112.598 178.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -118.06 170.82 8.54 Favored 'General case' 0 C--N 1.294 -1.824 0 CA-C-N 114.486 -1.234 . . . . 0.0 108.712 -172.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 19.1 m -72.0 127.84 33.82 Favored 'General case' 0 N--CA 1.427 -1.604 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 170.202 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 85.6 m -50.71 -22.14 1.95 Allowed 'General case' 0 C--N 1.315 -0.932 0 C-N-CA 125.495 1.518 . . . . 0.0 113.553 -178.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -80.51 7.43 9.93 Favored 'General case' 0 C--N 1.317 -0.816 0 C-N-CA 124.387 1.075 . . . . 0.0 111.561 -175.24 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 18.5 p -92.13 140.38 29.69 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 121.582 -0.699 . . . . 0.0 111.777 -179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -78.65 90.42 4.58 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-O 121.8 0.81 . . . . 0.0 109.294 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.406 ' O ' ' HA ' ' A' ' 24' ' ' SER . 82.8 m-20 -126.61 -178.58 4.42 Favored 'General case' 0 C--O 1.196 -1.746 0 CA-C-N 114.94 -1.027 . . . . 0.0 108.991 -178.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.726 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.7 mpt_? -100.85 -175.44 2.89 Favored 'General case' 0 C--N 1.283 -2.293 0 N-CA-C 107.111 -1.441 . . . . 0.0 107.111 -175.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.478 ' CH2' HG23 ' A' ' 23' ' ' VAL . 26.9 p90 -154.27 169.69 23.05 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 119.492 1.042 . . . . 0.0 112.199 -176.909 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.403 HG13 ' HB3' ' A' ' 64' ' ' PHE . 74.2 mt -122.22 125.74 73.33 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.884 0 CA-C-O 121.4 0.619 . . . . 0.0 109.855 178.142 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 87.0 m -104.1 142.82 33.8 Favored 'General case' 0 C--N 1.289 -2.037 0 CA-C-N 115.448 -0.796 . . . . 0.0 108.929 176.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . . . . . . . . . 6.7 pt20 -117.93 132.76 56.37 Favored 'General case' 0 N--CA 1.413 -2.305 0 N-CA-C 106.717 -1.586 . . . . 0.0 106.717 172.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.541 ' HB2' ' CZ3' ' A' ' 10' ' ' TRP . 42.9 tttp -109.98 106.49 16.03 Favored 'General case' 0 C--N 1.251 -3.7 0 N-CA-C 104.048 -2.575 . . . . 0.0 104.048 173.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -83.53 124.73 31.04 Favored 'General case' 0 N--CA 1.41 -2.437 0 CA-C-N 114.357 -1.292 . . . . 0.0 109.902 -170.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.584 ' HG ' ' H ' ' A' ' 4' ' ' LEU . 1.5 mm? -71.89 -30.94 65.92 Favored 'General case' 0 N--CA 1.43 -1.451 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.264 -175.489 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' TYR . . . . . 0.523 ' CD1' ' HB3' ' A' ' 15' ' ' ASP . 20.0 m-85 -93.2 85.46 5.05 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-O 122.391 1.091 . . . . 0.0 112.527 176.294 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 51.6 p-80 -140.17 139.17 35.66 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 103.528 -2.768 . . . . 0.0 103.528 176.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.401 ' HB3' ' H ' ' A' ' 130' ' ' THR . 59.6 mm-40 56.78 -155.63 0.31 Allowed 'General case' 0 N--CA 1.468 0.474 0 O-C-N 123.698 0.624 . . . . 0.0 109.32 -176.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . 0.401 ' H ' ' HB3' ' A' ' 129' ' ' GLU . 18.2 m -146.29 138.9 25.36 Favored 'General case' 0 C--N 1.279 -2.486 0 N-CA-C 105.242 -2.133 . . . . 0.0 105.242 172.196 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.593 HD23 ' H ' ' A' ' 131' ' ' LEU . 1.7 pt? -61.93 101.27 0.2 Allowed 'General case' 0 C--O 1.248 1.018 0 CA-C-O 121.924 0.869 . . . . 0.0 109.254 176.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 19.8 m -99.72 159.93 14.68 Favored 'General case' 0 N--CA 1.422 -1.844 0 CA-C-N 114.415 -1.266 . . . . 0.0 110.846 -173.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 53.4 m-80 -116.56 -77.93 0.57 Allowed 'General case' 0 C--N 1.302 -1.495 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.174 176.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -146.06 144.03 29.78 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 109.003 -0.739 . . . . 0.0 109.003 -178.759 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 47.3 t -91.87 -61.5 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.329 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 175.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 85.72 -49.6 4.18 Favored Glycine 0 N--CA 1.442 -0.92 0 CA-C-N 116.042 -0.526 . . . . 0.0 114.055 176.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 97.8 m-85 66.53 -82.84 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.921 0.888 . . . . 0.0 109.676 -175.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -151.2 16.79 0.89 Allowed Glycine 0 N--CA 1.433 -1.559 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 176.297 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 12.8 p-80 . . . . . 0 N--CA 1.436 -1.152 0 CA-C-O 118.748 -0.644 . . . . 0.0 109.489 -178.888 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 18.0 m . . . . . 0 C--O 1.238 0.47 0 N-CA-C 110.15 -0.315 . . . . 0.0 110.15 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.619 ' HA ' ' OH ' ' A' ' 127' ' ' TYR . . . 72.12 138.37 0.05 OUTLIER 'General case' 0 C--N 1.353 0.725 0 C-N-CA 124.616 1.166 . . . . 0.0 112.893 177.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.2 ttpt 74.22 137.24 0.06 Allowed 'General case' 0 CA--C 1.544 0.743 0 CA-C-O 122.11 0.957 . . . . 0.0 113.434 176.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.466 ' H ' ' CD2' ' A' ' 126' ' ' LEU . 3.6 mp -115.83 -159.35 0.71 Allowed 'General case' 0 C--N 1.31 -1.133 0 CA-C-N 114.409 -1.269 . . . . 0.0 107.792 -177.611 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 33.4 mt-10 -94.31 145.03 25.03 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-N 118.419 0.554 . . . . 0.0 111.189 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 71.0 m -113.25 164.08 16.55 Favored Pre-proline 0 C--N 1.301 -1.511 0 N-CA-C 109.133 -0.691 . . . . 0.0 109.133 179.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.475 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 38.5 Cg_exo -60.75 157.67 36.6 Favored 'Trans proline' 0 C--N 1.368 1.573 0 C-N-CA 121.448 1.432 . . . . 0.0 110.956 174.028 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 12.7 pt20 -44.13 -45.35 8.17 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 -174.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -92.47 2.18 56.82 Favored 'General case' 0 C--N 1.317 -0.83 0 C-N-CA 120.651 -0.42 . . . . 0.0 110.513 -172.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.475 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 23.9 m95 -99.98 126.87 46.22 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-O 121.793 0.806 . . . . 0.0 111.788 -173.781 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 13.2 tp -84.69 119.41 25.22 Favored 'General case' 0 N--CA 1.412 -2.347 0 CA-C-N 113.753 -1.567 . . . . 0.0 108.081 -175.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.6 t -92.72 130.79 38.23 Favored 'General case' 0 C--N 1.272 -2.781 0 CA-C-O 120.897 0.38 . . . . 0.0 111.092 -173.078 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.459 ' CE1' ' HG2' ' A' ' 14' ' ' ARG . 48.3 t-80 -153.31 130.03 10.83 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 123.212 0.605 . . . . 0.0 109.696 -179.345 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.459 ' HG2' ' CE1' ' A' ' 13' ' ' HIS . 24.0 mmt180 65.11 -81.04 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 125.439 1.495 . . . . 0.0 113.011 178.677 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -157.77 26.07 0.27 Allowed 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 107.656 -1.239 . . . . 0.0 107.656 -174.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 4.0 mppt? -141.98 163.75 32.03 Favored 'General case' 0 C--O 1.242 0.659 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.441 -179.491 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.676 ' SG ' HD13 ' A' ' 126' ' ' LEU . 13.1 m -123.96 131.07 53.51 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 106.638 -1.616 . . . . 0.0 106.638 176.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.432 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 22.6 m-85 -111.15 135.73 51.23 Favored 'General case' 0 C--N 1.304 -1.406 0 CA-C-O 120.999 0.428 . . . . 0.0 111.907 -175.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -121.53 102.08 8.02 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 173.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 98.3 t -81.1 95.18 2.62 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 107.8 -1.185 . . . . 0.0 107.8 176.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.753 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 9.4 m -77.77 108.03 10.71 Favored 'General case' 0 N--CA 1.414 -2.248 0 CA-C-N 115.416 -0.811 . . . . 0.0 108.98 -178.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.524 HE22 ' ND2' ' A' ' 62' ' ' ASN . 0.0 OUTLIER -83.34 14.79 3.34 Favored 'General case' 0 N--CA 1.474 0.774 0 C-N-CA 123.997 0.919 . . . . 0.0 112.67 -179.409 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.472 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 10.4 m -105.7 158.89 6.02 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.801 0 N-CA-C 107.204 -1.406 . . . . 0.0 107.204 178.52 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 17.3 m -111.4 148.38 33.18 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 114.356 1.243 . . . . 0.0 114.356 -171.815 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 37.0 m-20 -158.15 -176.69 6.06 Favored 'General case' 0 C--N 1.319 -0.758 0 C-N-CA 127.379 2.272 . . . . 0.0 107.825 -179.036 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 82.7 p -84.68 176.62 8.45 Favored 'General case' 0 C--O 1.258 1.525 0 N-CA-C 106.6 -1.63 . . . . 0.0 106.6 171.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.9 t90 -63.02 -47.0 84.93 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 109.632 -0.507 . . . . 0.0 109.632 177.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.443 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 43.1 mt-10 -67.76 -38.01 82.87 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.692 -0.685 . . . . 0.0 111.946 -177.013 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -64.33 -46.07 85.13 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 120.456 -0.498 . . . . 0.0 111.429 176.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -62.9 -35.66 92.33 Favored Glycine 0 C--N 1.333 0.375 0 C-N-CA 120.165 -1.017 . . . . 0.0 111.574 177.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 3.2 tm? -55.39 -52.16 64.45 Favored 'General case' 0 C--O 1.249 1.043 0 C-N-CA 123.797 0.839 . . . . 0.0 108.999 176.005 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 84.8 t -68.1 -32.59 56.71 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.647 0 CA-C-N 115.513 -0.767 . . . . 0.0 110.971 -178.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -61.8 -36.35 80.86 Favored 'General case' 0 C--N 1.319 -0.753 0 CA-C-N 116.257 -0.429 . . . . 0.0 111.783 177.179 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 59.0 m -69.38 -40.37 77.47 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 109.729 -0.471 . . . . 0.0 109.729 176.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -60.44 -29.42 69.0 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-O 121.369 0.604 . . . . 0.0 109.589 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -60.76 -30.24 72.16 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 114.816 -1.084 . . . . 0.0 113.248 179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 3.5 mptp? -96.8 1.86 51.21 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 117.245 0.522 . . . . 0.0 111.027 178.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 72.0 53.28 9.55 Favored Glycine 0 N--CA 1.436 -1.346 0 N-CA-C 108.53 -1.828 . . . . 0.0 108.53 -172.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -147.3 177.28 9.34 Favored 'General case' 0 N--CA 1.424 -1.746 0 N-CA-C 107.942 -1.133 . . . . 0.0 107.942 -179.236 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.437 ' HB ' HD11 ' A' ' 80' ' ' ILE . 11.2 p -120.85 159.56 25.24 Favored 'General case' 0 C--N 1.284 -2.28 0 C-N-CA 122.917 0.487 . . . . 0.0 110.402 -176.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 30.7 tp -73.97 131.62 41.59 Favored 'General case' 0 C--N 1.307 -1.258 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 174.635 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 17.4 tpt -29.38 122.7 0.15 Allowed 'General case' 0 N--CA 1.506 2.333 0 N-CA-C 116.77 2.137 . . . . 0.0 116.77 -170.392 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.481 ' CD1' ' HB3' ' A' ' 79' ' ' TRP . 2.9 mm? -112.94 108.09 16.89 Favored 'General case' 0 CA--C 1.532 0.283 0 N-CA-C 107.372 -1.344 . . . . 0.0 107.372 177.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.552 HD13 HD11 ' A' ' 50' ' ' LEU . 54.4 mt -83.38 118.15 30.43 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.7 0 O-C-N 122.211 -0.305 . . . . 0.0 110.556 -175.617 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -79.73 -45.79 18.26 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.16 -178.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -154.15 179.85 8.56 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 -174.293 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.3 -36.27 79.08 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -60.3 -27.89 67.67 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-N 115.392 -0.822 . . . . 0.0 111.498 178.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -68.17 -52.13 38.05 Favored 'General case' 0 N--CA 1.435 -1.195 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 178.152 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.554 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 29.4 mt -66.22 -24.26 66.58 Favored 'General case' 0 C--O 1.206 -1.209 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 179.429 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 69.6 ttt180 -64.71 -35.93 82.65 Favored 'General case' 0 N--CA 1.393 -3.285 0 N-CA-C 109.448 -0.575 . . . . 0.0 109.448 179.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -72.1 -31.74 66.34 Favored 'General case' 0 N--CA 1.443 -0.799 0 CA-C-N 115.701 -0.682 . . . . 0.0 109.265 175.198 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.607 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.4 mm? -64.21 -52.67 57.69 Favored 'General case' 0 C--O 1.192 -1.922 0 N-CA-C 109.335 -0.617 . . . . 0.0 109.335 176.922 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.554 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 45.4 mt -54.77 -40.63 69.59 Favored 'General case' 0 C--O 1.252 1.233 0 C-N-CA 123.178 0.591 . . . . 0.0 112.246 -177.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 26.2 m-20 -70.2 -36.8 74.85 Favored 'General case' 0 C--N 1.323 -0.574 0 N-CA-C 112.529 0.566 . . . . 0.0 112.529 178.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 19.8 p -81.96 -33.55 30.19 Favored 'General case' 0 C--N 1.31 -1.152 0 C-N-CA 120.824 -0.351 . . . . 0.0 111.451 -178.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.607 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.1 mm -56.07 -45.97 80.68 Favored 'Isoleucine or valine' 0 C--O 1.241 0.609 0 C-N-CA 123.878 0.871 . . . . 0.0 109.545 176.019 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 4.1 tppp? 66.12 -68.64 0.13 Allowed 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.435 1.094 . . . . 0.0 113.093 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -60.36 -38.64 84.5 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 124.656 1.183 . . . . 0.0 114.182 -174.222 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.536 ' H ' HG22 ' A' ' 57' ' ' ILE . 41.8 mmtm 71.94 -53.34 0.69 Allowed 'General case' 0 C--O 1.212 -0.913 0 N-CA-C 113.6 0.963 . . . . 0.0 113.6 175.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -67.3 35.16 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.0 0 C-N-CA 126.321 1.848 . . . . 0.0 114.494 -171.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.524 ' ND2' HE22 ' A' ' 22' ' ' GLN . 93.2 m-20 -127.49 -173.61 2.96 Favored 'General case' 0 C--N 1.273 -2.749 0 N-CA-C 106.994 -1.484 . . . . 0.0 106.994 177.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.681 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 50.2 m -142.66 121.9 13.03 Favored 'General case' 0 C--N 1.311 -1.103 0 N-CA-C 107.791 -1.188 . . . . 0.0 107.791 177.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.472 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 3.0 m-85 -123.64 117.6 25.36 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 109.329 -0.619 . . . . 0.0 109.329 -176.463 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.403 ' CE2' ' HB2' ' A' ' 118' ' ' ASN . 78.9 m95 -60.77 139.02 58.05 Favored 'General case' 0 C--N 1.312 -1.036 0 C-N-CA 123.53 0.732 . . . . 0.0 111.207 179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -119.48 176.25 3.53 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.128 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 170.51 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.517 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -76.94 48.41 2.7 Favored Glycine 0 C--O 1.22 -0.745 0 CA-C-N 118.736 0.698 . . . . 0.0 114.128 -174.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.452 HD21 HD13 ' A' ' 85' ' ' LEU . 48.3 mt -113.1 115.42 28.28 Favored 'General case' 0 N--CA 1.434 -1.225 0 C-N-CA 123.295 0.638 . . . . 0.0 112.105 -179.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -126.22 146.81 49.83 Favored 'General case' 0 C--N 1.298 -1.649 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 173.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.458 ' CZ ' HD21 ' A' ' 72' ' ' LEU . 30.0 t80 -96.37 113.19 24.76 Favored 'General case' 0 C--N 1.277 -2.582 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -177.111 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 17.1 p -107.2 127.66 53.72 Favored 'General case' 0 C--N 1.297 -1.7 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.69 -175.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.458 HD21 ' CZ ' ' A' ' 70' ' ' TYR . 86.1 mt -120.09 150.59 51.48 Favored Pre-proline 0 C--N 1.305 -1.359 0 N-CA-C 110.45 -0.204 . . . . 0.0 110.45 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -85.11 141.75 32.95 Favored 'Cis proline' 0 C--O 1.24 0.599 0 C-N-CA 123.996 -1.252 . . . . 0.0 111.581 -3.031 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.413 ' OD2' ' HB2' ' A' ' 76' ' ' ASN . 22.0 t70 174.48 -36.34 0.0 OUTLIER 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 106.37 -1.715 . . . . 0.0 106.37 -177.521 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.3 mpt? 63.82 15.41 9.04 Favored 'General case' 0 CA--C 1.507 -0.701 0 CA-C-N 113.418 -1.719 . . . . 0.0 113.707 176.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . 0.413 ' HB2' ' OD2' ' A' ' 74' ' ' ASP . 10.5 m120 -124.71 165.62 17.62 Favored 'General case' 0 N--CA 1.419 -2.003 0 N-CA-C 107.716 -1.216 . . . . 0.0 107.716 174.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -92.62 138.14 31.76 Favored 'General case' 0 C--N 1.281 -2.399 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 -177.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -118.87 152.42 36.31 Favored 'General case' 0 C--N 1.292 -1.908 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 179.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.611 ' HB2' ' OD1' ' A' ' 81' ' ' ASN . 23.7 m95 -98.2 170.76 8.66 Favored 'General case' 0 C--N 1.293 -1.854 0 CA-C-N 115.463 -0.79 . . . . 0.0 108.909 -179.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.437 HD11 ' HB ' ' A' ' 40' ' ' THR . 48.1 pt -73.23 -12.33 15.47 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.368 0 CA-C-N 115.797 -0.638 . . . . 0.0 111.882 -179.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.611 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 33.3 p-10 -86.17 -8.08 58.09 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.243 0.544 . . . . 0.0 109.665 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.39 6.48 57.54 Favored Glycine 0 CA--C 1.523 0.577 0 CA-C-N 114.903 -1.044 . . . . 0.0 113.473 178.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 3.5 t -96.05 174.16 7.06 Favored 'General case' 0 C--N 1.315 -0.913 0 N-CA-C 109.618 -0.512 . . . . 0.0 109.618 -178.286 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 59.3 m -106.55 145.55 31.72 Favored 'General case' 0 N--CA 1.439 -0.99 0 CA-C-O 121.256 0.551 . . . . 0.0 109.864 177.138 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.52 HD11 HD12 ' A' ' 92' ' ' ILE . 28.4 tp -54.23 144.21 20.77 Favored 'General case' 0 C--N 1.307 -1.278 0 C-N-CA 125.987 1.715 . . . . 0.0 113.41 178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 48.6 t-20 -92.34 89.83 6.99 Favored 'General case' 0 N--CA 1.434 -1.227 0 N-CA-C 105.742 -1.947 . . . . 0.0 105.742 170.192 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 15.8 m -70.37 -12.24 61.45 Favored 'General case' 0 C--N 1.31 -1.15 0 CA-C-N 115.819 -0.628 . . . . 0.0 111.486 -175.578 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -77.66 -10.66 59.64 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-N 115.752 -0.658 . . . . 0.0 112.435 -176.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.4 m -75.46 -51.28 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.604 0 N-CA-C 113.577 0.954 . . . . 0.0 113.577 -176.083 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 95.0 mt -155.21 -177.96 6.91 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 108.755 -0.831 . . . . 0.0 108.755 -173.557 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.413 ' HD2' ' HB3' ' A' ' 108' ' ' LYS . 0.0 OUTLIER -63.98 102.67 0.51 Allowed 'General case' 0 C--O 1.22 -0.473 0 N-CA-C 114.72 1.378 . . . . 0.0 114.72 -179.064 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.52 HD12 HD11 ' A' ' 85' ' ' LEU . 7.7 mt -143.47 98.65 0.63 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.479 0 N-CA-C 106.914 -1.513 . . . . 0.0 106.914 171.096 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 6.1 m -60.49 127.69 32.95 Favored 'General case' 0 C--N 1.309 -1.159 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.364 -178.184 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -86.96 -43.8 5.89 Favored Glycine 0 N--CA 1.414 -2.808 0 N-CA-C 108.78 -1.728 . . . . 0.0 108.78 -179.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -85.96 85.44 7.37 Favored 'General case' 0 N--CA 1.428 -1.575 0 CA-C-O 122.727 1.251 . . . . 0.0 110.925 177.802 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.1 t -122.16 -32.33 3.7 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 114.471 -1.241 . . . . 0.0 110.394 178.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.6 mt-10 56.06 34.36 23.62 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 123.935 0.894 . . . . 0.0 111.811 176.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . 0.442 ' O ' ' HD2' ' A' ' 70' ' ' TYR . 35.1 m-80 -108.57 -171.7 1.91 Allowed 'General case' 0 C--O 1.213 -0.838 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.829 176.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -119.52 25.75 9.85 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-O 123.019 1.39 . . . . 0.0 107.299 177.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.424 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 22.9 t -73.9 157.65 35.89 Favored 'General case' 0 C--N 1.298 -1.65 0 CA-C-N 113.854 -1.521 . . . . 0.0 111.544 -174.323 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 72.2 m -121.59 144.89 48.48 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 177.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . 0.455 ' HA ' ' HA ' ' A' ' 111' ' ' PHE . . . -95.31 150.48 20.21 Favored 'General case' 0 C--O 1.251 1.15 0 N-CA-C 113.654 0.983 . . . . 0.0 113.654 -173.883 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.19 154.43 43.85 Favored 'General case' 0 N--CA 1.445 -0.697 0 C-N-CA 124.571 1.148 . . . . 0.0 109.664 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.681 ' O ' ' HA ' ' A' ' 63' ' ' SER . 14.1 mm -77.65 116.27 20.87 Favored 'Isoleucine or valine' 0 CA--C 1.49 -1.354 0 N-CA-C 106.41 -1.7 . . . . 0.0 106.41 173.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.414 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 6.4 t -129.3 93.11 3.49 Favored 'General case' 0 N--CA 1.405 -2.685 0 N-CA-C 106.749 -1.574 . . . . 0.0 106.749 179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . . . . . . . . . . . 87.79 -133.51 11.85 Favored Glycine 0 N--CA 1.431 -1.668 0 N-CA-C 110.541 -1.024 . . . . 0.0 110.541 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . 0.487 ' OD2' ' HE2' ' A' ' 60' ' ' LYS . 8.1 m-20 -97.73 15.05 24.79 Favored 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 174.272 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.413 ' HB3' ' HD2' ' A' ' 91' ' ' LYS . 29.8 mmtp -125.38 168.99 12.79 Favored 'General case' 0 N--CA 1.43 -1.448 0 CA-C-N 114.987 -1.006 . . . . 0.0 108.706 -174.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 5.2 t -115.53 133.32 62.25 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.003 0 N-CA-C 104.214 -2.513 . . . . 0.0 104.214 173.48 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.7 p -129.15 167.79 17.08 Favored 'General case' 0 C--N 1.278 -2.514 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.455 ' HA ' ' HA ' ' A' ' 102' ' ' ALA . 6.2 p90 -122.74 128.08 50.04 Favored 'General case' 0 C--N 1.285 -2.234 0 CA-C-O 121.444 0.64 . . . . 0.0 111.105 176.78 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.401 ' HB2' ' CH2' ' A' ' 65' ' ' TRP . 21.4 mm-40 -120.81 170.02 9.86 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-N 114.59 -1.186 . . . . 0.0 108.805 -172.402 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 22.9 m -65.78 128.41 35.89 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 170.25 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 11.7 m -61.21 -18.91 60.64 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.242 0.617 . . . . 0.0 112.292 -172.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -88.84 0.16 56.8 Favored 'General case' 0 C--N 1.311 -1.088 0 CA-C-N 115.622 -0.717 . . . . 0.0 111.935 -178.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 64.7 p -80.32 150.09 30.05 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 119.78 -0.768 . . . . 0.0 111.989 -177.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -76.76 106.15 8.25 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 115.659 -0.7 . . . . 0.0 110.142 179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . 0.403 ' HB2' ' CE2' ' A' ' 65' ' ' TRP . 78.2 m-20 -143.67 172.46 12.79 Favored 'General case' 0 CA--C 1.489 -1.372 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 178.437 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.753 ' HB3' ' O ' ' A' ' 21' ' ' SER . 1.6 mpt_? -93.74 -174.82 3.56 Favored 'General case' 0 C--N 1.285 -2.217 0 N-CA-C 105.853 -1.906 . . . . 0.0 105.853 -177.398 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 24.4 p90 -155.36 167.56 29.98 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 119.897 1.226 . . . . 0.0 111.619 -177.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.45 HD13 HD12 ' A' ' 53' ' ' LEU . 79.5 mt -124.06 123.55 66.96 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.883 0 CA-C-O 121.234 0.54 . . . . 0.0 110.052 178.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 79.0 m -100.84 138.93 37.23 Favored 'General case' 0 C--N 1.29 -2.014 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.103 176.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.552 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.0 pt20 -123.43 140.49 52.95 Favored 'General case' 0 N--CA 1.413 -2.293 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 173.3 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm -109.5 124.31 50.86 Favored 'General case' 0 C--N 1.246 -3.91 0 N-CA-C 106.25 -1.759 . . . . 0.0 106.25 175.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.447 ' HG2' ' O ' ' A' ' 127' ' ' TYR . 41.1 tt0 -72.22 114.22 10.1 Favored 'General case' 0 N--CA 1.429 -1.48 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 177.166 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.676 HD13 ' SG ' ' A' ' 17' ' ' CYS . 13.6 tp -72.83 -24.15 60.86 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-N 114.274 -1.33 . . . . 0.0 110.224 -171.03 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' TYR . . . . . 0.619 ' OH ' ' HA ' ' A' ' 2' ' ' ALA . 33.4 m-85 -94.89 116.75 29.1 Favored 'General case' 0 C--N 1.296 -1.737 0 CA-C-N 114.951 -1.022 . . . . 0.0 108.964 172.917 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 82.8 m-70 -99.8 43.55 1.05 Allowed 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 109.086 -0.709 . . . . 0.0 109.086 -173.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . 0.445 ' HG2' ' HB3' ' A' ' 127' ' ' TYR . 10.8 mm-40 -75.07 69.77 2.0 Allowed 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 122.252 1.025 . . . . 0.0 111.96 -174.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 61.0 m -160.59 -51.55 0.05 OUTLIER 'General case' 0 C--N 1.298 -1.631 0 N-CA-C 105.955 -1.868 . . . . 0.0 105.955 176.63 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 87.4 mt -99.7 23.02 10.12 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 107.529 -1.285 . . . . 0.0 107.529 177.537 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 10.2 p -73.71 110.9 8.37 Favored 'General case' 0 N--CA 1.418 -2.037 0 CA-C-N 113.936 -1.484 . . . . 0.0 109.151 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 10.2 m120 66.6 -83.25 0.03 OUTLIER 'General case' 0 CA--C 1.489 -1.382 0 C-N-CA 124.273 1.029 . . . . 0.0 111.216 -175.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -142.58 142.58 32.18 Favored 'General case' 0 N--CA 1.42 -1.945 0 N-CA-C 107.764 -1.199 . . . . 0.0 107.764 -174.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 43.3 t -88.09 -23.71 6.39 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.613 0 CA-C-O 121.729 0.776 . . . . 0.0 109.013 179.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 91.73 44.48 4.22 Favored Glycine 0 N--CA 1.431 -1.668 0 CA-C-N 115.184 -0.916 . . . . 0.0 111.015 -179.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -68.66 147.36 52.0 Favored 'General case' 0 N--CA 1.447 -0.581 0 CA-C-O 121.208 0.527 . . . . 0.0 110.837 -179.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 120.63 -27.05 6.69 Favored Glycine 0 C--N 1.293 -1.85 0 N-CA-C 109.611 -1.395 . . . . 0.0 109.611 -178.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 57.2 t-80 . . . . . 0 C--O 1.243 0.746 0 C-N-CA 124.266 1.027 . . . . 0.0 110.36 179.648 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 8.8 t . . . . . 0 CA--C 1.551 0.981 0 CA-C-O 121.435 0.636 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.67 96.47 6.52 Favored 'General case' 0 N--CA 1.434 -1.242 0 O-C-N 121.857 -0.527 . . . . 0.0 109.894 -179.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 14' ' ' ARG . 15.5 mtpt -37.46 145.88 0.06 Allowed 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 126.482 1.913 . . . . 0.0 114.999 174.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.524 ' H ' ' HG ' ' A' ' 126' ' ' LEU . 4.8 mp -107.86 -154.91 0.54 Allowed 'General case' 0 C--N 1.3 -1.565 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 173.902 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -86.71 141.03 29.2 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 118.621 0.646 . . . . 0.0 112.178 -177.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.9 m -120.68 156.06 56.41 Favored Pre-proline 0 C--N 1.309 -1.186 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.955 177.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.492 ' HB2' ' CD1' ' A' ' 10' ' ' TRP . 15.4 Cg_exo -66.36 164.41 28.45 Favored 'Trans proline' 0 CA--C 1.55 1.279 0 C-N-CA 121.733 1.622 . . . . 0.0 111.344 174.445 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.425 ' HG3' ' N ' ' A' ' 9' ' ' ASP . 11.4 pt20 -50.73 -46.1 58.92 Favored 'General case' 0 CA--C 1.557 1.238 0 N-CA-C 114.198 1.184 . . . . 0.0 114.198 -173.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.425 ' N ' ' HG3' ' A' ' 8' ' ' GLN . 22.4 m-20 -92.74 24.29 3.67 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-O 120.749 0.309 . . . . 0.0 111.282 -173.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.492 ' CD1' ' HB2' ' A' ' 7' ' ' PRO . 26.6 m95 -122.17 131.98 54.22 Favored 'General case' 0 C--N 1.295 -1.802 0 C-N-CA 120.603 -0.439 . . . . 0.0 110.527 -177.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.35 135.97 33.12 Favored 'General case' 0 C--N 1.312 -1.064 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 177.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.1 t -98.48 123.3 42.55 Favored 'General case' 0 C--N 1.292 -1.92 0 C-N-CA 120.498 -0.481 . . . . 0.0 110.112 -177.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.404 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 43.0 t-80 -130.39 108.15 9.77 Favored 'General case' 0 C--N 1.324 -0.528 0 O-C-N 121.938 -0.476 . . . . 0.0 110.949 179.147 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.533 ' O ' ' HG3' ' A' ' 3' ' ' LYS . 42.0 mtm180 59.59 -68.63 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 126.451 1.901 . . . . 0.0 113.642 177.236 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -147.8 19.66 1.15 Allowed 'General case' 0 C--N 1.301 -1.511 0 CA-C-N 116.604 -0.271 . . . . 0.0 111.427 -173.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.583 ' HG3' ' HA ' ' A' ' 125' ' ' GLU . 3.9 mppt? -150.87 151.99 33.03 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 123.231 0.612 . . . . 0.0 109.926 176.672 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.698 ' SG ' HD13 ' A' ' 126' ' ' LEU . 8.3 m -108.22 136.71 47.43 Favored 'General case' 0 C--N 1.31 -1.115 0 N-CA-C 107.388 -1.338 . . . . 0.0 107.388 177.507 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.424 ' O ' ' HA ' ' A' ' 10' ' ' TRP . 13.6 m-85 -113.27 142.0 46.34 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 118.669 0.668 . . . . 0.0 111.546 -176.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . 0.443 ' HB2' ' CD2' ' A' ' 10' ' ' TRP . 35.1 t60 -128.15 112.57 14.7 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 107.779 -1.193 . . . . 0.0 107.779 175.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 61.8 t -94.12 98.57 8.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.826 0 N-CA-C 107.85 -1.167 . . . . 0.0 107.85 178.163 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.762 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 4.8 m -77.69 117.86 19.5 Favored 'General case' 0 C--N 1.294 -1.817 0 N-CA-C 108.987 -0.745 . . . . 0.0 108.987 -179.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.437 HE22 ' ND2' ' A' ' 62' ' ' ASN . 14.3 mm100 -86.97 14.39 7.46 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.855 0.836 . . . . 0.0 111.726 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.499 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 7.2 m -111.44 156.31 12.61 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.295 0 N-CA-C 106.855 -1.535 . . . . 0.0 106.855 179.486 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 55.1 m -103.51 158.98 15.98 Favored 'General case' 0 C--N 1.29 -2.015 0 N-CA-C 114.604 1.335 . . . . 0.0 114.604 -173.258 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 36.5 m-20 -162.96 170.98 17.25 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 127.716 2.407 . . . . 0.0 107.896 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 21.7 p -81.64 165.62 20.9 Favored 'General case' 0 C--N 1.295 -1.778 0 N-CA-C 106.978 -1.49 . . . . 0.0 106.978 170.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -58.42 -50.95 71.86 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 118.737 0.699 . . . . 0.0 112.051 -174.53 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.443 ' O ' ' HB3' ' A' ' 31' ' ' LEU . 38.6 mt-10 -66.26 -32.01 73.17 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.596 0.712 . . . . 0.0 110.793 -176.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 51.6 tt0 -70.42 -44.56 67.65 Favored 'General case' 0 C--N 1.305 -1.356 0 CA-C-N 115.303 -0.862 . . . . 0.0 109.454 179.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.33 -35.22 91.77 Favored Glycine 0 C--N 1.34 0.761 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 176.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.443 ' HB3' ' O ' ' A' ' 28' ' ' GLU . 2.7 tm? -55.68 -52.26 64.45 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 175.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 69.3 t -65.77 -35.06 74.27 Favored 'Isoleucine or valine' 0 C--O 1.244 0.778 0 CA-C-N 115.55 -0.75 . . . . 0.0 110.68 -179.593 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.05 -36.5 81.81 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.113 -0.494 . . . . 0.0 111.726 176.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 72.6 m -67.44 -42.6 82.86 Favored 'General case' 0 CA--C 1.507 -0.698 0 N-CA-C 110.29 -0.263 . . . . 0.0 110.29 176.557 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -62.75 -23.11 67.03 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.217 177.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -61.96 -33.91 87.12 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.749 -0.66 . . . . 0.0 112.169 176.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -93.94 10.22 34.26 Favored 'General case' 0 C--N 1.324 -0.514 0 O-C-N 122.284 -0.539 . . . . 0.0 110.056 177.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.85 40.85 84.52 Favored Glycine 0 CA--C 1.495 -1.176 0 N-CA-C 110.317 -1.113 . . . . 0.0 110.317 -176.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.547 ' HB1' ' O ' ' A' ' 123' ' ' GLN . . . -131.28 176.79 7.99 Favored 'General case' 0 N--CA 1.416 -2.125 0 CA-C-N 114.723 -0.738 . . . . 0.0 109.29 -176.321 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -117.62 162.14 18.51 Favored 'General case' 0 C--N 1.284 -2.269 0 C-N-CA 123.24 0.616 . . . . 0.0 109.571 178.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 32.3 tp -81.1 121.95 26.73 Favored 'General case' 0 C--N 1.311 -1.076 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 16.8 tpt -21.05 118.42 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.075 0 N-CA-C 117.291 2.33 . . . . 0.0 117.291 -168.633 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.467 HD23 ' NE2' ' A' ' 123' ' ' GLN . 3.2 mm? -112.09 105.9 14.39 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.816 1.246 . . . . 0.0 108.127 178.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.414 ' HB ' ' CH2' ' A' ' 79' ' ' TRP . 24.2 mt -93.73 130.43 42.71 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.828 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 -175.406 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 -110.08 -26.36 9.73 Favored 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.987 -0.685 . . . . 0.0 111.994 176.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.426 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 14.6 t70 -136.96 167.25 21.85 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.334 -0.546 . . . . 0.0 111.291 -173.443 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.23 -37.55 75.02 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 124.162 0.985 . . . . 0.0 108.556 -179.162 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.585 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 6.6 pt-20 -60.3 -27.29 67.19 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-O 121.197 0.522 . . . . 0.0 110.688 -178.971 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.426 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 1.6 mt-10 -63.54 -54.62 33.26 Favored 'General case' 0 N--CA 1.422 -1.842 0 N-CA-C 108.698 -0.852 . . . . 0.0 108.698 179.536 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.644 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 51.2 mt -68.44 -27.73 66.44 Favored 'General case' 0 CA--C 1.499 -0.986 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 -179.603 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.585 ' HG2' ' O ' ' A' ' 48' ' ' GLU . 16.5 ptt180 -66.02 -34.81 78.95 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.564 -0.854 . . . . 0.0 108.901 177.102 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -72.44 -33.69 67.25 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.065 -1.087 . . . . 0.0 108.065 177.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.659 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -61.11 -49.46 77.21 Favored 'General case' 0 CA--C 1.48 -1.717 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.644 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 54.2 mt -56.18 -34.51 66.28 Favored 'General case' 0 C--N 1.314 -0.951 0 O-C-N 123.563 0.539 . . . . 0.0 112.092 -178.664 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 48.3 m-20 -65.69 -44.58 85.75 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 120.86 0.362 . . . . 0.0 110.66 175.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 35.1 p -76.6 -27.55 55.81 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 116.037 -0.529 . . . . 0.0 112.019 -178.817 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.659 HG12 ' O ' ' A' ' 53' ' ' LEU . 42.9 mm -66.79 -55.77 16.71 Favored 'Isoleucine or valine' 0 C--O 1.243 0.75 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 177.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 22.6 tptm 66.05 -63.23 0.24 Allowed 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 124.855 1.262 . . . . 0.0 113.492 -179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -65.52 -39.93 92.37 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 122.69 0.396 . . . . 0.0 111.583 -175.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.557 ' H ' HG22 ' A' ' 57' ' ' ILE . 94.6 mttt 70.99 -47.3 0.65 Allowed 'General case' 0 N--CA 1.485 1.293 0 N-CA-C 115.276 1.584 . . . . 0.0 115.276 173.219 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -67.3 -1.0 3.98 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 115.359 1.615 . . . . 0.0 115.359 -170.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.592 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 61.7 m-80 -82.04 -160.98 0.4 Allowed 'General case' 0 C--N 1.31 -1.111 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 174.215 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.429 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 18.9 m -142.63 114.03 7.85 Favored 'General case' 0 C--N 1.311 -1.098 0 N-CA-C 107.065 -1.457 . . . . 0.0 107.065 178.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.592 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 2.7 m-85 -121.61 118.52 29.41 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 117.636 0.198 . . . . 0.0 110.696 -175.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . 0.4 ' CH2' ' HB2' ' A' ' 112' ' ' GLU . 74.9 m95 -62.33 142.91 57.54 Favored 'General case' 0 C--N 1.312 -1.048 0 C-N-CA 123.239 0.616 . . . . 0.0 112.018 179.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -121.15 176.28 4.17 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.95 0 N-CA-C 106.997 -1.483 . . . . 0.0 106.997 168.106 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.585 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.15 47.06 2.55 Favored Glycine 0 C--O 1.217 -0.92 0 CA-C-N 118.71 0.686 . . . . 0.0 114.309 -174.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 26.9 mt -112.13 118.56 35.69 Favored 'General case' 0 CA--C 1.494 -1.184 0 C-N-CA 123.818 0.847 . . . . 0.0 111.209 179.453 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 21.4 ptt180 -127.39 136.08 51.36 Favored 'General case' 0 C--N 1.296 -1.75 0 CA-C-N 115.538 -0.756 . . . . 0.0 109.08 178.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 26.0 t80 -90.46 112.7 24.43 Favored 'General case' 0 C--N 1.294 -1.81 0 N-CA-C 106.31 -1.737 . . . . 0.0 106.31 177.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.594 ' O ' ' HB3' ' A' ' 74' ' ' ASP . 1.4 p -92.65 115.56 28.22 Favored 'General case' 0 C--N 1.298 -1.667 0 CA-C-N 116.126 -0.488 . . . . 0.0 112.04 -175.184 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.419 HD23 ' O ' ' A' ' 71' ' ' THR . 40.0 mt -120.83 140.59 30.96 Favored Pre-proline 0 C--N 1.318 -0.778 0 C-N-CA 121.075 -0.25 . . . . 0.0 110.439 175.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -83.69 130.69 16.3 Favored 'Cis proline' 0 C--O 1.245 0.838 0 C-N-CA 123.445 -1.481 . . . . 0.0 110.845 -3.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.594 ' HB3' ' O ' ' A' ' 71' ' ' THR . 13.4 t70 176.89 -44.2 0.01 OUTLIER 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 106.506 -1.664 . . . . 0.0 106.506 -174.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.516 ' HG2' ' OE1' ' A' ' 97' ' ' GLU . 83.2 mtp 70.41 21.98 5.45 Favored 'General case' 0 CA--C 1.497 -1.069 0 CA-C-N 114.387 -1.279 . . . . 0.0 114.174 173.024 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 20.1 m120 -117.32 157.26 26.41 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 120.424 -0.511 . . . . 0.0 110.575 174.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 83.5 m95 -94.01 107.05 19.0 Favored 'General case' 0 N--CA 1.422 -1.839 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 171.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 52.5 mttp -105.28 145.98 29.96 Favored 'General case' 0 C--N 1.275 -2.64 0 CA-C-N 115.591 -0.731 . . . . 0.0 109.807 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.585 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 47.8 m95 -87.25 165.02 15.98 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 176.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 47.0 pt -67.19 -17.83 23.23 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.263 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.515 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 32.7 p-10 -85.9 -9.59 56.68 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.171 0.51 . . . . 0.0 109.742 179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 97.75 8.23 55.95 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-N 115.649 -0.705 . . . . 0.0 114.234 177.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 7.2 t -85.37 174.8 9.29 Favored 'General case' 0 C--O 1.245 0.863 0 CA-C-N 117.537 0.668 . . . . 0.0 109.911 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 88.0 m -101.18 140.68 35.14 Favored 'General case' 0 N--CA 1.42 -1.944 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 178.175 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.615 HD11 HD12 ' A' ' 92' ' ' ILE . 40.8 tp -53.92 132.56 42.21 Favored 'General case' 0 C--N 1.308 -1.228 0 N-CA-C 113.687 0.995 . . . . 0.0 113.687 178.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 55.1 t-20 -92.47 81.86 4.87 Favored 'General case' 0 N--CA 1.436 -1.146 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 170.657 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 13.4 p -71.74 -11.99 61.09 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.361 0.601 . . . . 0.0 111.19 -177.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -77.34 -1.45 30.0 Favored 'General case' 0 C--N 1.31 -1.121 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.664 -177.466 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 33.7 m -80.7 -47.69 20.31 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.022 0 C-N-CA 119.056 -1.058 . . . . 0.0 111.446 174.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.408 ' HB2' HG23 ' A' ' 109' ' ' VAL . 95.5 mt -154.86 177.79 10.89 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.528 0.731 . . . . 0.0 109.147 -175.3 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 52.4 pttt -67.52 117.05 8.94 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -175.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.615 HD12 HD11 ' A' ' 85' ' ' LEU . 8.8 mt -149.86 114.57 0.68 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.97 0 N-CA-C 106.317 -1.735 . . . . 0.0 106.317 172.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 4.7 m -69.88 128.66 37.15 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.725 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -81.45 -30.69 35.95 Favored Glycine 0 N--CA 1.418 -2.503 0 N-CA-C 110.149 -1.18 . . . . 0.0 110.149 -174.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 7.3 p-10 -112.7 117.37 32.04 Favored 'General case' 0 N--CA 1.423 -1.806 0 N-CA-C 109.621 -0.511 . . . . 0.0 109.621 176.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.5 t -142.73 -19.89 0.67 Allowed 'General case' 0 C--N 1.289 -2.025 0 C-N-CA 119.041 -1.064 . . . . 0.0 111.199 -179.632 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . 0.516 ' OE1' ' HG2' ' A' ' 75' ' ' MET . 10.2 mm-40 49.86 64.77 1.64 Allowed 'General case' 0 CA--C 1.51 -0.569 0 CA-C-O 121.732 0.777 . . . . 0.0 112.765 -178.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -141.97 167.3 22.46 Favored 'General case' 0 N--CA 1.438 -1.056 0 CA-C-N 115.131 -0.941 . . . . 0.0 110.857 -174.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -90.54 29.14 1.34 Allowed 'General case' 0 C--N 1.301 -1.536 0 C-N-CA 126.905 2.082 . . . . 0.0 107.48 175.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . 0.428 ' OG ' ' HB2' ' A' ' 111' ' ' PHE . 21.7 t -91.43 151.24 20.89 Favored 'General case' 0 N--CA 1.427 -1.598 0 CA-C-N 113.738 -1.574 . . . . 0.0 113.51 -171.089 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 66.8 m -130.87 151.63 51.08 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 105.625 -1.991 . . . . 0.0 105.625 174.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -92.76 149.51 21.25 Favored 'General case' 0 C--O 1.251 1.139 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 -173.867 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -143.1 148.15 36.16 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.396 1.078 . . . . 0.0 110.328 -178.172 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.433 HD11 HD22 ' A' ' 50' ' ' LEU . 12.1 mm -77.07 125.61 37.02 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.378 0 C-N-CA 124.348 1.059 . . . . 0.0 108.414 177.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 8.8 t -149.85 95.34 2.3 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 107.749 -1.204 . . . . 0.0 107.749 176.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.444 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . 105.51 -143.19 15.65 Favored Glycine 0 C--N 1.296 -1.657 0 N-CA-C 109.083 -1.607 . . . . 0.0 109.083 -178.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -99.03 15.03 27.12 Favored 'General case' 0 C--N 1.308 -1.207 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 172.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 66.7 mmtt -128.19 171.3 12.07 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 114.972 -1.013 . . . . 0.0 108.767 -173.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.408 HG23 ' HB2' ' A' ' 90' ' ' LEU . 10.5 t -104.21 142.46 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.654 0 N-CA-C 105.615 -1.995 . . . . 0.0 105.615 173.804 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 74.3 p -131.88 175.73 8.96 Favored 'General case' 0 C--N 1.278 -2.508 0 N-CA-C 106.899 -1.519 . . . . 0.0 106.899 178.055 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . 0.428 ' HB2' ' OG ' ' A' ' 100' ' ' SER . 19.4 p90 -138.9 139.04 37.93 Favored 'General case' 0 C--N 1.296 -1.738 0 CA-C-N 119.229 0.922 . . . . 0.0 112.743 177.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . 0.4 ' HB2' ' CH2' ' A' ' 65' ' ' TRP . 16.8 mm-40 -125.24 168.5 13.38 Favored 'General case' 0 C--N 1.318 -0.803 0 N-CA-C 106.507 -1.664 . . . . 0.0 106.507 -177.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 31.0 m -66.9 136.2 55.01 Favored 'General case' 0 C--N 1.31 -1.126 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 174.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . . . . . . . . . 33.8 m -57.62 -16.88 11.71 Favored 'General case' 0 N--CA 1.498 1.951 0 N-CA-C 112.998 0.74 . . . . 0.0 112.998 -173.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -95.41 7.95 44.7 Favored 'General case' 0 C--N 1.306 -1.3 0 C-N-CA 123.683 0.793 . . . . 0.0 110.491 -173.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 51.1 p -90.67 140.06 30.13 Favored 'General case' 0 N--CA 1.427 -1.576 0 C-N-CA 119.873 -0.731 . . . . 0.0 110.893 -179.701 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -75.93 106.5 7.55 Favored 'General case' 0 C--N 1.301 -1.541 0 CA-C-N 115.802 -0.635 . . . . 0.0 109.449 179.316 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 51.9 m-80 -141.25 172.22 12.98 Favored 'General case' 0 C--O 1.207 -1.157 0 C-N-CA 124.077 0.951 . . . . 0.0 108.684 -179.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.762 ' HB3' ' O ' ' A' ' 21' ' ' SER . 4.7 mpt_? -83.3 -179.68 7.45 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.434 -1.321 . . . . 0.0 107.434 -176.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 15.3 p90 -154.56 161.95 41.38 Favored 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 118.092 -1.443 . . . . 0.0 112.375 -175.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 82.0 mt -119.83 122.25 68.16 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.839 0 CA-C-O 121.415 0.626 . . . . 0.0 110.282 179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 79.4 m -100.46 148.81 24.34 Favored 'General case' 0 C--N 1.289 -2.046 0 CA-C-N 115.42 -0.809 . . . . 0.0 108.955 177.081 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.547 ' O ' ' HB1' ' A' ' 39' ' ' ALA . 5.4 pt20 -125.98 139.05 53.75 Favored 'General case' 0 N--CA 1.418 -2.028 0 N-CA-C 106.733 -1.581 . . . . 0.0 106.733 172.306 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -109.51 109.04 19.73 Favored 'General case' 0 C--N 1.259 -3.343 0 N-CA-C 103.699 -2.704 . . . . 0.0 103.699 171.494 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.583 ' HA ' ' HG3' ' A' ' 16' ' ' LYS . 0.3 OUTLIER -63.72 116.44 5.72 Favored 'General case' 0 N--CA 1.424 -1.747 0 CA-C-O 122.17 0.986 . . . . 0.0 109.406 -176.98 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.698 HD13 ' SG ' ' A' ' 17' ' ' CYS . 12.4 tp -77.35 -35.68 54.4 Favored 'General case' 0 N--CA 1.415 -2.178 0 CA-C-N 113.923 -1.49 . . . . 0.0 108.188 -170.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -86.52 84.83 7.33 Favored 'General case' 0 N--CA 1.426 -1.625 0 N-CA-C 108.253 -1.018 . . . . 0.0 108.253 168.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 21.6 m80 -74.34 115.88 14.36 Favored 'General case' 0 C--N 1.306 -1.299 0 CA-C-N 115.672 -0.695 . . . . 0.0 109.259 176.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -81.2 91.03 6.11 Favored 'General case' 0 C--N 1.295 -1.789 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 176.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 25.7 m -95.6 -48.85 5.64 Favored 'General case' 0 N--CA 1.424 -1.751 0 CA-C-N 115.243 -0.889 . . . . 0.0 109.942 -178.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 94.3 mt -67.46 136.8 55.2 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 116.151 -0.477 . . . . 0.0 109.927 179.167 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 32.0 t -100.96 120.35 40.04 Favored 'General case' 0 N--CA 1.416 -2.149 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 37.6 m-80 -99.85 16.4 23.87 Favored 'General case' 0 CA--C 1.489 -1.392 0 CA-C-O 121.889 0.852 . . . . 0.0 108.996 179.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 69.3 m-85 -130.19 -176.85 4.08 Favored 'General case' 0 N--CA 1.406 -2.625 0 CA-C-N 114.662 -1.153 . . . . 0.0 109.532 -175.641 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 41.6 t -142.89 67.26 0.16 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 N-CA-C 104.45 -2.426 . . . . 0.0 104.45 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 94.06 -87.3 1.12 Allowed Glycine 0 C--N 1.288 -2.128 0 CA-C-N 113.357 -1.747 . . . . 0.0 110.074 179.187 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -121.0 -72.02 0.71 Allowed 'General case' 0 C--N 1.303 -1.441 0 N-CA-C 108.366 -0.976 . . . . 0.0 108.366 174.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -165.53 72.33 0.18 Allowed Glycine 0 N--CA 1.435 -1.392 0 C-N-CA 119.891 -1.147 . . . . 0.0 113.246 179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 12.3 p80 . . . . . 0 C--N 1.31 -1.122 0 N-CA-C 107.447 -1.316 . . . . 0.0 107.447 176.03 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 38.9 m . . . . . 0 C--O 1.244 0.78 0 N-CA-C 111.606 0.225 . . . . 0.0 111.606 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . 0.409 ' HB2' ' CB ' ' A' ' 12' ' ' SER . . . -99.71 150.58 22.15 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-O 120.4 0.143 . . . . 0.0 111.077 -177.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.475 ' HA ' ' HE3' ' A' ' 3' ' ' LYS . 2.2 tpmt? -77.64 -63.94 1.26 Allowed 'General case' 0 C--N 1.317 -0.832 0 CA-C-O 122.604 1.192 . . . . 0.0 109.376 174.422 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.417 HD13 ' HG ' ' A' ' 126' ' ' LEU . 3.9 mp -99.82 -149.79 0.37 Allowed 'General case' 0 C--N 1.273 -2.724 0 N-CA-C 105.53 -2.026 . . . . 0.0 105.53 174.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -115.74 139.34 50.25 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 119.764 1.165 . . . . 0.0 112.25 178.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 75.5 m -101.4 157.06 34.39 Favored Pre-proline 0 C--N 1.303 -1.449 0 CA-C-N 114.752 -1.113 . . . . 0.0 109.904 -177.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -64.98 164.18 25.78 Favored 'Trans proline' 0 C--N 1.363 1.305 0 C-N-CA 121.713 1.609 . . . . 0.0 111.667 175.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 -49.66 -44.57 47.82 Favored 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.627 1.343 . . . . 0.0 114.627 -176.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 19.0 m-20 -80.83 15.43 1.78 Allowed 'General case' 0 N--CA 1.48 1.046 0 N-CA-C 112.575 0.583 . . . . 0.0 112.575 -172.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 43.2 m95 -125.85 153.77 43.64 Favored 'General case' 0 C--N 1.304 -1.394 0 O-C-N 121.468 -0.77 . . . . 0.0 112.712 -172.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -94.83 -176.69 3.94 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 105.657 -1.979 . . . . 0.0 105.657 169.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.409 ' CB ' ' HB2' ' A' ' 2' ' ' ALA . 28.5 p -148.22 140.99 24.63 Favored 'General case' 0 C--N 1.298 -1.642 0 C-N-CA 120.248 -0.581 . . . . 0.0 111.605 -179.551 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 44.5 t-80 -148.96 108.31 3.95 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 176.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.6 mmt180 70.29 -85.35 0.03 OUTLIER 'General case' 0 C--N 1.32 -0.682 0 C-N-CA 125.366 1.466 . . . . 0.0 111.524 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -138.52 27.65 2.5 Favored 'General case' 0 C--N 1.299 -1.591 0 CA-C-N 115.968 -0.56 . . . . 0.0 110.789 -174.916 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' A' ' 16' ' ' LYS . 0.0 OUTLIER -145.57 157.23 44.01 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 176.404 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.644 ' SG ' HD13 ' A' ' 126' ' ' LEU . 7.6 m -112.69 140.79 47.17 Favored 'General case' 0 C--N 1.284 -2.28 0 N-CA-C 106.497 -1.668 . . . . 0.0 106.497 177.008 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -116.63 145.77 43.17 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 118.801 0.728 . . . . 0.0 111.44 -177.481 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -137.52 106.57 5.99 Favored 'General case' 0 C--N 1.299 -1.612 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 176.217 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.5 t -90.05 101.59 12.39 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.793 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 177.066 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.709 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 5.5 m -78.13 111.17 13.77 Favored 'General case' 0 C--N 1.29 -2.0 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.498 HE22 ' ND2' ' A' ' 62' ' ' ASN . 13.2 mm100 -79.01 14.73 1.3 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.77 0.828 . . . . 0.0 113.027 -178.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.583 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 15.6 m -111.65 156.11 12.84 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.032 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 -179.002 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 39.1 m -102.54 141.9 34.6 Favored 'General case' 0 C--N 1.294 -1.829 0 N-CA-C 114.094 1.146 . . . . 0.0 114.094 -171.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -152.39 169.73 21.83 Favored 'General case' 0 C--N 1.325 -0.465 0 C-N-CA 128.084 2.554 . . . . 0.0 106.842 -179.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 38.2 p -80.45 169.88 17.11 Favored 'General case' 0 C--O 1.253 1.278 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 169.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . 0.473 ' HB3' ' HB3' ' A' ' 114' ' ' CYS . 92.9 t90 -57.42 -49.04 77.49 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-O 120.743 0.306 . . . . 0.0 111.314 -176.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -67.05 -35.14 79.21 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 116.511 -0.313 . . . . 0.0 111.444 -179.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 39.8 mt-10 -61.73 -47.77 83.74 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-O 120.519 0.199 . . . . 0.0 110.715 176.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -63.4 -35.87 92.63 Favored Glycine 0 CA--C 1.504 -0.631 0 C-N-CA 121.031 -0.604 . . . . 0.0 112.252 179.615 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 1.6 tt -58.99 -50.94 72.19 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 96.7 t -64.14 -32.99 59.59 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 CA-C-N 115.667 -0.697 . . . . 0.0 110.504 179.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.19 -36.69 84.48 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.945 175.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 60.5 m -68.04 -39.78 83.01 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 109.692 -0.484 . . . . 0.0 109.692 176.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -58.43 -33.16 69.39 Favored 'General case' 0 N--CA 1.485 1.319 0 CA-C-O 121.162 0.505 . . . . 0.0 109.842 176.38 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -60.03 -28.3 66.1 Favored Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 114.914 -1.039 . . . . 0.0 113.517 178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 1.9 mptp? -99.37 5.8 46.28 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 117.346 0.573 . . . . 0.0 110.302 177.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 68.5 49.94 41.02 Favored Glycine 0 N--CA 1.44 -1.046 0 N-CA-C 109.383 -1.487 . . . . 0.0 109.383 -174.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -146.28 177.38 9.05 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 108.636 -0.875 . . . . 0.0 108.636 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.2 p -118.88 165.59 13.87 Favored 'General case' 0 C--N 1.29 -2.014 0 C-N-CA 122.623 0.369 . . . . 0.0 110.587 -178.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 28.7 tp -77.54 132.02 38.15 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 106.719 -1.586 . . . . 0.0 106.719 177.734 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 18.1 tpt -30.38 121.93 0.19 Allowed 'General case' 0 N--CA 1.499 1.976 0 N-CA-C 116.646 2.091 . . . . 0.0 116.646 -169.774 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.449 HD12 ' HB3' ' A' ' 79' ' ' TRP . 2.6 mm? -114.39 98.64 7.04 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 107.973 -1.121 . . . . 0.0 107.973 178.124 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.502 HD13 HD21 ' A' ' 50' ' ' LEU . 40.8 mt -79.04 123.33 35.87 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.499 0 N-CA-C 109.134 -0.691 . . . . 0.0 109.134 -177.238 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 71.9 mm-40 -100.36 -20.63 15.75 Favored 'General case' 0 C--N 1.318 -0.789 0 C-N-CA 120.055 -0.658 . . . . 0.0 112.45 -179.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.512 ' H ' ' HG3' ' A' ' 49' ' ' GLU . 21.3 t70 -159.72 169.69 23.14 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -174.715 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.0 tt0 -73.34 -21.32 60.57 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 117.942 0.337 . . . . 0.0 110.781 178.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.471 ' HB2' ' OD2' ' A' ' 46' ' ' ASP . 0.5 OUTLIER -57.85 -34.41 69.7 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 123.847 0.859 . . . . 0.0 109.109 175.365 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.512 ' HG3' ' H ' ' A' ' 46' ' ' ASP . 3.5 mm-40 -63.16 -55.04 28.54 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.546 -1.206 . . . . 0.0 109.296 177.914 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.636 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 79.6 mt -65.8 -24.81 67.0 Favored 'General case' 0 CA--C 1.496 -1.126 0 N-CA-C 113.715 1.006 . . . . 0.0 113.715 -175.815 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 33.0 ttt180 -63.32 -44.93 93.53 Favored 'General case' 0 N--CA 1.402 -2.835 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 71.9 t80 -73.0 -25.28 60.92 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-N 115.744 -0.662 . . . . 0.0 109.654 179.172 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.674 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.2 mm? -63.52 -51.39 65.71 Favored 'General case' 0 C--O 1.184 -2.377 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 174.32 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.636 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 39.4 mt -51.96 -40.51 60.97 Favored 'General case' 0 C--N 1.311 -1.077 0 O-C-N 123.882 0.739 . . . . 0.0 111.562 179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.34 -40.1 95.2 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 116.059 -0.519 . . . . 0.0 112.092 176.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.3 p -85.61 -9.69 56.93 Favored 'General case' 0 CA--C 1.548 0.894 0 CA-C-O 121.468 0.651 . . . . 0.0 111.793 -179.126 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.674 HG12 ' O ' ' A' ' 53' ' ' LEU . 26.8 mm -83.54 -52.4 13.04 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.643 0 CA-C-N 115.768 -0.651 . . . . 0.0 110.083 176.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? 68.24 -69.86 0.14 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.209 1.004 . . . . 0.0 112.732 -178.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.9 mt-10 -59.12 -59.92 4.7 Favored 'General case' 0 C--O 1.215 -0.74 0 C-N-CA 123.049 0.539 . . . . 0.0 111.895 -175.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.437 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 45.9 mtmt 75.03 -10.83 1.15 Allowed 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.81 1.244 . . . . 0.0 112.772 -177.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -77.54 -21.95 51.83 Favored 'General case' 0 C--N 1.317 -0.808 0 CA-C-O 120.682 0.277 . . . . 0.0 111.708 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.585 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 30.2 m-80 -78.84 -169.62 1.84 Allowed 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 109.231 -0.655 . . . . 0.0 109.231 -179.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.513 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 15.9 m -140.96 122.97 15.53 Favored 'General case' 0 C--N 1.296 -1.758 0 N-CA-C 106.592 -1.632 . . . . 0.0 106.592 178.113 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.585 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.8 m-85 -124.5 120.21 31.36 Favored 'General case' 0 C--N 1.314 -0.958 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 -174.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -63.57 137.75 58.24 Favored 'General case' 0 C--N 1.311 -1.107 0 O-C-N 123.64 0.587 . . . . 0.0 111.451 179.43 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -115.67 175.13 2.86 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.041 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 168.766 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.584 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -77.53 44.55 2.25 Favored Glycine 0 C--O 1.216 -0.995 0 CA-C-N 118.792 0.724 . . . . 0.0 114.277 -174.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 0.478 ' HG ' ' CZ3' ' A' ' 79' ' ' TRP . 14.9 mt -113.51 123.81 50.9 Favored 'General case' 0 CA--C 1.486 -1.498 0 C-N-CA 124.154 0.981 . . . . 0.0 111.534 -179.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 8.5 ptm180 -133.09 144.66 50.13 Favored 'General case' 0 C--N 1.295 -1.786 0 C-N-CA 120.387 -0.525 . . . . 0.0 110.037 171.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.443 ' OH ' ' HG2' ' A' ' 75' ' ' MET . 82.6 t80 -85.15 128.86 34.83 Favored 'General case' 0 C--N 1.289 -2.045 0 N-CA-C 106.3 -1.741 . . . . 0.0 106.3 177.395 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 34.5 p -115.7 128.88 56.22 Favored 'General case' 0 C--N 1.278 -2.52 0 N-CA-C 112.681 0.623 . . . . 0.0 112.681 -173.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.416 HD23 ' H ' ' A' ' 75' ' ' MET . 43.1 mt -120.76 149.55 50.82 Favored Pre-proline 0 N--CA 1.435 -1.179 0 N-CA-C 109.349 -0.611 . . . . 0.0 109.349 172.745 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -87.01 125.91 8.44 Favored 'Cis proline' 0 CA--C 1.54 0.817 0 C-N-CA 123.539 -1.442 . . . . 0.0 112.517 -2.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 2.7 p30 171.58 -33.45 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.746 1.618 . . . . 0.0 110.008 177.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.443 ' HG2' ' OH ' ' A' ' 70' ' ' TYR . 83.2 mtp 70.71 22.62 4.83 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 123.819 0.7 . . . . 0.0 111.626 176.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -107.45 155.37 20.12 Favored 'General case' 0 C--N 1.3 -1.575 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.442 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 80.9 m95 -103.29 118.47 36.84 Favored 'General case' 0 C--N 1.3 -1.555 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 4.1 mppt? -125.58 157.29 37.52 Favored 'General case' 0 C--N 1.292 -1.915 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.509 177.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.584 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 40.0 m95 -95.62 165.76 12.17 Favored 'General case' 0 C--N 1.294 -1.805 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.02 -178.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 44.1 pt -67.11 -17.03 22.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.977 0 N-CA-C 112.254 0.465 . . . . 0.0 112.254 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.464 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 26.7 p-10 -86.26 -15.98 39.05 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 179.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 105.11 8.49 36.09 Favored Glycine 0 C--N 1.317 -0.523 0 CA-C-N 115.623 -0.717 . . . . 0.0 112.665 176.112 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 44.7 m -80.0 162.39 24.91 Favored 'General case' 0 C--N 1.302 -1.464 0 C-N-CA 122.617 0.367 . . . . 0.0 111.304 175.443 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 27.1 m -99.93 140.57 33.96 Favored 'General case' 0 N--CA 1.438 -1.065 0 N-CA-C 107.809 -1.182 . . . . 0.0 107.809 175.466 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.465 ' HA ' ' HE1' ' A' ' 79' ' ' TRP . 48.9 tp -68.21 133.21 48.49 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 113.558 0.947 . . . . 0.0 113.558 179.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . . . . . . . . . 43.9 t30 -89.26 91.07 8.62 Favored 'General case' 0 N--CA 1.437 -1.079 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 167.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 16.2 m -70.99 -7.99 50.1 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.599 -177.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -77.75 -4.46 46.45 Favored 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 113.911 1.078 . . . . 0.0 113.911 -179.411 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 34.6 m -75.11 -52.95 17.4 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.688 0 C-N-CA 118.646 -1.221 . . . . 0.0 110.939 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.5 mt -144.29 -178.44 5.97 Favored 'General case' 0 C--N 1.315 -0.892 0 N-CA-C 108.259 -1.015 . . . . 0.0 108.259 -176.455 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.411 ' HB2' ' HE3' ' A' ' 91' ' ' LYS . 18.8 ptmt -69.41 111.53 5.35 Favored 'General case' 0 C--N 1.307 -1.248 0 N-CA-C 114.421 1.267 . . . . 0.0 114.421 -177.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.425 HD12 HD21 ' A' ' 85' ' ' LEU . 9.4 mt -146.67 120.18 2.21 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.239 0 N-CA-C 105.11 -2.182 . . . . 0.0 105.11 173.196 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . 0.419 HG22 ' H ' ' A' ' 95' ' ' ASP . 8.0 m -101.42 138.22 38.71 Favored 'General case' 0 C--N 1.296 -1.734 0 CA-C-O 120.631 0.253 . . . . 0.0 110.6 -173.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -95.18 -15.29 45.21 Favored Glycine 0 N--CA 1.432 -1.624 0 N-CA-C 109.864 -1.294 . . . . 0.0 109.864 178.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . 0.419 ' H ' HG22 ' A' ' 93' ' ' THR . 4.2 m-20 -83.03 114.79 21.52 Favored 'General case' 0 C--N 1.304 -1.396 0 N-CA-C 107.361 -1.348 . . . . 0.0 107.361 174.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 7.0 t -170.18 -40.45 0.02 OUTLIER 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 -177.61 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 69.1 mm-40 67.64 17.3 9.89 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -177.692 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 40.6 m-80 -102.41 -171.33 1.94 Allowed 'General case' 0 C--N 1.313 -1.004 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 -177.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -118.31 26.63 9.48 Favored 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 105.908 -1.886 . . . . 0.0 105.908 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 32.3 t -66.2 158.87 27.69 Favored 'General case' 0 C--N 1.312 -1.044 0 CA-C-N 112.302 -2.226 . . . . 0.0 113.654 -172.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -135.1 154.56 51.63 Favored 'General case' 0 C--N 1.298 -1.631 0 C-N-CA 124.831 1.253 . . . . 0.0 108.074 175.534 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -97.61 150.58 20.98 Favored 'General case' 0 C--N 1.312 -1.041 0 N-CA-C 113.151 0.797 . . . . 0.0 113.151 -172.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -142.51 146.49 34.75 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 114.633 -1.167 . . . . 0.0 109.926 -179.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.513 ' O ' ' HA ' ' A' ' 63' ' ' SER . 8.7 mm -77.44 126.71 38.13 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.39 0 C-N-CA 124.084 0.954 . . . . 0.0 108.585 177.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . . . . . . . . . 9.2 t -154.36 96.47 1.92 Allowed 'General case' 0 N--CA 1.423 -1.781 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 175.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.437 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . 102.72 -144.18 16.03 Favored Glycine 0 N--CA 1.426 -1.969 0 N-CA-C 109.125 -1.59 . . . . 0.0 109.125 179.585 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -102.85 22.36 13.94 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 106.834 -1.543 . . . . 0.0 106.834 174.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 71.5 mmtt -129.91 169.69 14.88 Favored 'General case' 0 N--CA 1.426 -1.657 0 CA-C-N 114.171 -1.377 . . . . 0.0 107.81 -174.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 20.9 t -111.86 141.01 28.62 Favored 'Isoleucine or valine' 0 C--N 1.287 -2.13 0 N-CA-C 104.864 -2.272 . . . . 0.0 104.864 172.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 51.1 p -128.89 171.69 12.05 Favored 'General case' 0 C--N 1.277 -2.58 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -178.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 18.8 p90 -149.07 139.85 22.76 Favored 'General case' 0 C--N 1.305 -1.343 0 CA-C-N 118.739 0.7 . . . . 0.0 112.257 -178.589 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -147.27 -176.88 5.4 Favored 'General case' 0 C--N 1.307 -1.271 0 CA-C-N 115.378 -0.828 . . . . 0.0 110.335 177.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 23.5 m -72.93 125.48 27.67 Favored 'General case' 0 C--N 1.296 -1.739 0 O-C-N 123.378 0.424 . . . . 0.0 110.328 179.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' A' ' 27' ' ' TRP . 77.4 m -47.03 -23.27 0.44 Allowed 'General case' 0 N--CA 1.492 1.631 0 C-N-CA 126.803 2.041 . . . . 0.0 114.312 -177.692 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -83.03 -1.17 51.98 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-N 115.472 -0.785 . . . . 0.0 112.83 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 19.9 p -80.37 154.33 27.79 Favored 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 119.946 -0.701 . . . . 0.0 109.674 172.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 20.1 t70 -94.41 106.21 18.19 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 109.413 -0.588 . . . . 0.0 109.413 -175.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 54.8 m-80 -137.51 173.97 11.1 Favored 'General case' 0 C--O 1.204 -1.325 0 C-N-CA 123.179 0.592 . . . . 0.0 110.13 -177.109 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.709 ' HB3' ' O ' ' A' ' 21' ' ' SER . 3.6 mpt_? -81.95 175.51 10.32 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 107.486 -1.302 . . . . 0.0 107.486 -177.763 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 18.9 p90 -149.77 165.81 31.33 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-N 119.642 1.11 . . . . 0.0 111.939 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.482 HD13 HD12 ' A' ' 53' ' ' LEU . 70.1 mt -124.61 124.88 69.12 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.558 0 CA-C-O 121.356 0.598 . . . . 0.0 110.892 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 95.8 m -102.61 144.2 31.32 Favored 'General case' 0 C--N 1.296 -1.76 0 CA-C-N 115.409 -0.814 . . . . 0.0 109.41 177.294 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.419 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 5.7 pt20 -127.48 139.55 52.73 Favored 'General case' 0 N--CA 1.42 -1.95 0 N-CA-C 107.66 -1.237 . . . . 0.0 107.66 171.764 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 19.6 ttmm -110.64 118.25 35.7 Favored 'General case' 0 C--N 1.254 -3.567 0 N-CA-C 106.458 -1.682 . . . . 0.0 106.458 175.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -69.79 118.34 12.52 Favored 'General case' 0 N--CA 1.424 -1.758 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 175.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.644 HD13 ' SG ' ' A' ' 17' ' ' CYS . 12.8 tp -72.45 -23.36 61.05 Favored 'General case' 0 C--N 1.295 -1.793 0 CA-C-N 114.157 -1.383 . . . . 0.0 109.715 -172.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' TYR . . . . . 0.466 ' CE1' ' HG2' ' A' ' 3' ' ' LYS . 3.5 m-85 -73.36 27.54 0.06 Allowed 'General case' 0 C--N 1.316 -0.883 0 N-CA-C 113.99 1.107 . . . . 0.0 113.99 175.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . . . . . . . . . 36.6 t-80 -74.92 -22.15 58.78 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 106.232 -1.766 . . . . 0.0 106.232 168.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 47.6 mt-10 69.01 157.44 0.15 Allowed 'General case' 0 C--N 1.348 0.536 0 C-N-CA 125.996 1.718 . . . . 0.0 114.36 173.195 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 18.8 m -90.18 99.51 12.52 Favored 'General case' 0 N--CA 1.421 -1.922 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 177.236 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . 0.485 HD23 ' H ' ' A' ' 131' ' ' LEU . 2.0 pt? -76.08 160.02 30.19 Favored 'General case' 0 C--N 1.304 -1.372 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.322 -177.605 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 19.9 m 71.0 23.85 4.12 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.54 1.136 . . . . 0.0 111.985 176.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . . 84.4 m-20 62.76 -88.8 0.03 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.44 1.096 . . . . 0.0 111.933 179.638 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 98.5 m-85 -147.86 157.23 43.43 Favored 'General case' 0 N--CA 1.43 -1.429 0 N-CA-C 106.561 -1.644 . . . . 0.0 106.561 -177.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 39.9 t -80.19 -33.63 14.38 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.316 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 -179.202 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 125.64 -14.03 7.25 Favored Glycine 0 CA--C 1.504 -0.601 0 C-N-CA 120.222 -0.99 . . . . 0.0 112.149 177.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 99.8 m-85 63.92 -80.07 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.699 1.2 . . . . 0.0 112.876 178.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . -109.07 -0.38 31.59 Favored Glycine 0 N--CA 1.438 -1.169 0 C-N-CA 121.078 -0.582 . . . . 0.0 112.177 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . . . . . . . . . 46.0 t60 . . . . . 0 C--N 1.308 -1.219 0 CA-C-O 118.317 -0.849 . . . . 0.0 108.864 178.848 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 16.7 t . . . . . 0 C--O 1.248 0.999 0 N-CA-C 108.478 -0.934 . . . . 0.0 108.478 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -134.4 166.92 21.72 Favored 'General case' 0 C--N 1.31 -1.123 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 179.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.491 ' HG2' ' O ' ' A' ' 4' ' ' LEU . 0.0 OUTLIER -73.55 164.47 26.61 Favored 'General case' 0 C--N 1.311 -1.08 0 CA-C-O 121.479 0.657 . . . . 0.0 112.148 -179.591 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.491 ' O ' ' HG2' ' A' ' 3' ' ' LYS . 4.4 mp -94.02 -166.22 1.46 Allowed 'General case' 0 C--N 1.301 -1.52 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 21.8 mm-40 -87.8 142.92 27.44 Favored 'General case' 0 C--N 1.313 -0.985 0 N-CA-C 113.881 1.067 . . . . 0.0 113.881 -177.585 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 69.3 m -108.3 162.85 18.45 Favored Pre-proline 0 C--O 1.25 1.087 0 CA-C-N 114.452 -1.249 . . . . 0.0 110.77 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 23.4 Cg_exo -65.86 164.81 25.67 Favored 'Trans proline' 0 C--N 1.366 1.481 0 C-N-CA 122.493 2.129 . . . . 0.0 112.584 173.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -56.36 -21.51 25.15 Favored 'General case' 0 N--CA 1.486 1.352 0 C-N-CA 125.481 1.512 . . . . 0.0 114.669 -175.478 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 39.1 m-20 -85.17 -11.49 54.91 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-O 120.949 0.404 . . . . 0.0 110.411 -175.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 37.4 m95 -113.34 158.93 19.96 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 114.036 1.125 . . . . 0.0 114.036 -165.618 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -99.38 175.96 5.68 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 105.114 -2.18 . . . . 0.0 105.114 169.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . 0.417 ' HB2' ' HG3' ' A' ' 3' ' ' LYS . 33.7 p -139.9 132.39 28.6 Favored 'General case' 0 C--N 1.299 -1.598 0 CA-C-N 118.8 0.727 . . . . 0.0 111.34 -179.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' HIS . . . . . 0.469 ' HB3' ' CE2' ' A' ' 18' ' ' PHE . 42.8 t-80 -149.57 124.09 9.71 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 122.188 -0.32 . . . . 0.0 111.041 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.51 ' NE ' ' HA ' ' A' ' 14' ' ' ARG . 3.0 mmp_? 66.71 -72.58 0.08 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.07 1.348 . . . . 0.0 113.22 175.561 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.2 p-10 -158.98 21.37 0.2 Allowed 'General case' 0 C--N 1.306 -1.284 0 C-N-CA 122.79 0.436 . . . . 0.0 110.511 -179.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LYS . . . . . 0.526 ' HG2' ' NE2' ' A' ' 123' ' ' GLN . 0.0 OUTLIER -145.01 148.1 33.36 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 109.316 -0.624 . . . . 0.0 109.316 179.518 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' CYS . . . . . 0.555 ' O ' ' HA ' ' A' ' 123' ' ' GLN . 8.9 m -95.87 146.58 24.45 Favored 'General case' 0 C--N 1.286 -2.161 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 175.472 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' PHE . . . . . 0.469 ' CE2' ' HB3' ' A' ' 13' ' ' HIS . 22.3 m-85 -117.9 143.12 46.61 Favored 'General case' 0 C--N 1.302 -1.497 0 CA-C-N 118.624 0.647 . . . . 0.0 110.522 179.377 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 49.3 t-80 -132.25 107.99 8.94 Favored 'General case' 0 C--N 1.303 -1.426 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 176.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 69.0 t -89.67 96.03 5.89 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.672 0 N-CA-C 107.483 -1.302 . . . . 0.0 107.483 177.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.753 ' O ' ' HB3' ' A' ' 119' ' ' ARG . 5.0 m -78.08 108.29 11.26 Favored 'General case' 0 N--CA 1.423 -1.786 0 N-CA-C 108.685 -0.858 . . . . 0.0 108.685 -179.386 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.41 HE22 ' ND2' ' A' ' 62' ' ' ASN . 14.8 mm100 -80.09 14.75 1.74 Allowed 'General case' 0 N--CA 1.482 1.152 0 CA-C-O 121.437 0.637 . . . . 0.0 112.201 178.603 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.51 ' O ' ' HA ' ' A' ' 119' ' ' ARG . 6.0 m -103.13 150.06 6.92 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.881 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 -179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 25.4 m -106.01 141.55 37.2 Favored 'General case' 0 C--N 1.295 -1.78 0 N-CA-C 114.28 1.215 . . . . 0.0 114.28 -172.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.9 m-20 -154.16 174.39 14.8 Favored 'General case' 0 C--O 1.244 0.766 0 C-N-CA 127.906 2.483 . . . . 0.0 107.061 -176.009 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.404 ' HB ' ' O ' ' A' ' 114' ' ' CYS . 60.0 p -84.55 163.96 19.04 Favored 'General case' 0 C--O 1.255 1.366 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 169.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TRP . . . . . . . . . . . . . 82.9 t90 -53.19 -46.6 69.07 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 121.139 0.495 . . . . 0.0 111.852 -177.509 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 33.0 mt-10 -64.07 -37.26 86.8 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.928 -176.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -68.33 -45.44 72.9 Favored 'General case' 0 CA--C 1.504 -0.802 0 CA-C-N 115.93 -0.577 . . . . 0.0 110.659 179.007 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . -60.92 -34.84 89.08 Favored Glycine 0 CA--C 1.506 -0.502 0 C-N-CA 120.755 -0.736 . . . . 0.0 111.496 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 4.3 tt -56.34 -50.99 69.9 Favored 'General case' 0 C--O 1.25 1.092 0 N-CA-C 107.969 -1.123 . . . . 0.0 107.969 175.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 60.5 t -65.36 -38.95 83.78 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 115.428 -0.806 . . . . 0.0 110.958 -179.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -57.47 -40.05 77.71 Favored 'General case' 0 CA--C 1.507 -0.69 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 177.582 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 64.6 m -66.26 -39.68 89.63 Favored 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 109.538 -0.542 . . . . 0.0 109.538 177.069 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -62.57 -29.26 70.45 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 120.992 0.425 . . . . 0.0 110.838 178.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -72.94 -16.59 78.31 Favored Glycine 0 CA--C 1.521 0.426 0 CA-C-N 115.816 -0.629 . . . . 0.0 112.247 179.156 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -92.47 -11.16 35.39 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.306 -0.998 . . . . 0.0 108.306 177.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.2 31.12 29.14 Favored Glycine 0 N--CA 1.444 -0.825 0 N-CA-C 108.728 -1.749 . . . . 0.0 108.728 -171.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -129.81 176.98 7.59 Favored 'General case' 0 N--CA 1.42 -1.929 0 CA-C-N 114.755 -0.723 . . . . 0.0 110.096 -174.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . 0.485 ' HB ' HD11 ' A' ' 80' ' ' ILE . 2.9 p -115.3 157.85 23.21 Favored 'General case' 0 C--N 1.282 -2.329 0 CA-C-N 116.02 -0.536 . . . . 0.0 109.891 178.614 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 29.9 tp -66.47 140.68 58.03 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 105.977 -1.86 . . . . 0.0 105.977 173.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' MET . . . . . 0.431 ' HE3' ' HA ' ' A' ' 44' ' ' ILE . 16.3 tpt -39.31 120.75 1.07 Allowed 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 114.545 1.313 . . . . 0.0 114.545 -171.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 14.1 tp -121.04 90.52 3.34 Favored 'General case' 0 N--CA 1.434 -1.265 0 N-CA-C 106.427 -1.694 . . . . 0.0 106.427 -175.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ILE . . . . . 0.482 HD13 HD11 ' A' ' 50' ' ' LEU . 44.4 mt -67.61 122.74 19.34 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.269 0 CA-C-N 115.362 -0.835 . . . . 0.0 112.019 -171.639 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 32.5 tt0 -92.9 -21.85 19.59 Favored 'General case' 0 CA--C 1.552 1.058 0 CA-C-N 115.079 -0.964 . . . . 0.0 111.984 -176.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.58 ' O ' ' HB2' ' A' ' 49' ' ' GLU . 28.3 t70 -173.08 177.64 2.69 Favored 'General case' 0 N--CA 1.482 1.17 0 N-CA-C 110.166 -0.309 . . . . 0.0 110.166 -171.09 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -78.65 -31.06 46.67 Favored 'General case' 0 CA--C 1.529 0.143 0 O-C-N 121.576 -0.702 . . . . 0.0 111.274 177.745 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.415 ' HB2' ' OD2' ' A' ' 46' ' ' ASP . 0.7 OUTLIER -58.37 -30.23 66.62 Favored 'General case' 0 N--CA 1.441 -0.893 0 C-N-CA 124.052 0.941 . . . . 0.0 108.59 176.291 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLU . . . . . 0.58 ' HB2' ' O ' ' A' ' 46' ' ' ASP . 4.3 mm-40 -61.24 -56.27 22.52 Favored 'General case' 0 CA--C 1.503 -0.864 0 CA-C-N 114.833 -1.076 . . . . 0.0 109.429 174.636 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.603 ' O ' ' HG ' ' A' ' 54' ' ' LEU . 79.5 mt -69.58 -28.47 66.0 Favored 'General case' 0 CA--C 1.48 -1.716 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -175.032 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 24.4 ptt180 -69.97 -34.19 73.05 Favored 'General case' 0 N--CA 1.421 -1.905 0 C-N-CA 119.5 -0.88 . . . . 0.0 109.147 178.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 84.3 t80 -73.77 -28.28 61.58 Favored 'General case' 0 N--CA 1.443 -0.779 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 175.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.65 ' O ' HG12 ' A' ' 57' ' ' ILE . 4.0 mm? -61.47 -49.36 77.09 Favored 'General case' 0 C--O 1.182 -2.468 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 173.324 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.603 ' HG ' ' O ' ' A' ' 50' ' ' LEU . 37.9 mt -55.35 -35.4 65.18 Favored 'General case' 0 C--N 1.313 -0.996 0 O-C-N 123.236 0.335 . . . . 0.0 111.351 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -68.12 -42.59 79.98 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.296 -0.411 . . . . 0.0 111.073 176.339 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.2 p -79.51 -24.52 42.2 Favored 'General case' 0 C--N 1.316 -0.886 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -178.239 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.65 HG12 ' O ' ' A' ' 53' ' ' LEU . 36.4 mm -65.84 -51.36 62.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 N-CA-C 108.79 -0.818 . . . . 0.0 108.79 174.541 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 49.6 tptt 72.6 -65.67 0.34 Allowed 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 124.06 0.944 . . . . 0.0 113.472 -179.474 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -65.06 -55.32 19.55 Favored 'General case' 0 C--O 1.215 -0.715 0 CA-C-N 118.633 0.652 . . . . 0.0 112.429 -176.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.555 ' HB3' ' HA2' ' A' ' 106' ' ' GLY . 44.5 mtmt 69.44 21.34 6.9 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 123.429 0.692 . . . . 0.0 110.369 -177.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' TYR . . . . . . . . . . . . . 19.1 m-85 -120.17 19.7 12.17 Favored 'General case' 0 CA--C 1.517 -0.308 0 CA-C-O 121.272 0.558 . . . . 0.0 110.852 -177.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.538 ' HB2' ' CZ ' ' A' ' 64' ' ' PHE . 41.9 m-80 -124.47 -153.8 0.58 Allowed 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 -179.293 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' SER . . . . . 0.58 ' HA ' ' O ' ' A' ' 104' ' ' ILE . 5.6 t -149.8 126.97 11.31 Favored 'General case' 0 N--CA 1.435 -1.194 0 N-CA-C 106.307 -1.738 . . . . 0.0 106.307 175.715 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.538 ' CZ ' ' HB2' ' A' ' 62' ' ' ASN . 1.1 m-85 -129.57 113.37 14.74 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 -175.16 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' TRP . . . . . . . . . . . . . 70.8 m95 -57.63 136.76 56.84 Favored 'General case' 0 C--N 1.316 -0.865 0 C-N-CA 124.085 0.954 . . . . 0.0 112.29 -178.267 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -120.68 176.71 3.66 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 107.217 -1.401 . . . . 0.0 107.217 170.629 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.593 ' O ' ' HA ' ' A' ' 79' ' ' TRP . . . -78.19 56.63 4.02 Favored Glycine 0 C--O 1.204 -1.775 0 C-N-CA 120.449 -0.881 . . . . 0.0 113.814 -175.673 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 47.7 mt -125.03 121.07 33.3 Favored 'General case' 0 C--N 1.307 -1.25 0 C-N-CA 122.998 0.519 . . . . 0.0 111.718 -179.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 30.0 ptt180 -128.3 135.42 49.59 Favored 'General case' 0 C--N 1.304 -1.377 0 CA-C-N 116.11 -0.496 . . . . 0.0 110.084 176.845 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 63.8 t80 -81.33 113.5 19.48 Favored 'General case' 0 C--N 1.316 -0.881 0 N-CA-C 106.534 -1.654 . . . . 0.0 106.534 178.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 33.4 p -103.4 124.43 48.68 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.848 -174.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 65.1 mt -119.89 148.5 46.67 Favored Pre-proline 0 C--N 1.313 -0.999 0 CA-C-N 116.422 -0.354 . . . . 0.0 110.333 178.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -86.0 126.18 9.26 Favored 'Cis proline' 0 C--O 1.237 0.439 0 C-N-CA 123.651 -1.395 . . . . 0.0 110.426 -3.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 37.4 t70 176.64 -36.04 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.085 -1.08 . . . . 0.0 108.085 -174.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . . . . . . . . . 1.8 mpt? 64.03 8.62 4.08 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 125.441 1.497 . . . . 0.0 114.174 176.077 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ASN . . . . . . . . . . . . . 17.2 m120 -100.03 159.52 15.02 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 175.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . . . . . . . . . 71.3 m95 -100.82 122.42 43.4 Favored 'General case' 0 C--N 1.288 -2.074 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 177.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 37.6 mtmm -116.82 147.2 42.33 Favored 'General case' 0 C--N 1.291 -1.964 0 CA-C-N 116.277 -0.419 . . . . 0.0 110.183 178.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' TRP . . . . . 0.593 ' HA ' ' O ' ' A' ' 67' ' ' GLY . 16.1 m95 -91.0 178.14 6.09 Favored 'General case' 0 C--N 1.317 -0.841 0 O-C-N 123.951 0.782 . . . . 0.0 109.504 -177.621 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.485 HD11 ' HB ' ' A' ' 40' ' ' THR . 48.6 pt -73.06 -12.46 15.63 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.728 0 CA-C-N 116.111 -0.495 . . . . 0.0 112.028 -179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ASN . . . . . 0.478 ' OD1' ' HB2' ' A' ' 79' ' ' TRP . 31.5 p-10 -95.55 -0.91 51.52 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-O 121.802 0.81 . . . . 0.0 109.021 178.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . 88.1 5.58 76.51 Favored Glycine 0 N--CA 1.446 -0.636 0 CA-C-N 114.5 -1.227 . . . . 0.0 113.563 176.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.9 t -81.83 169.4 16.92 Favored 'General case' 0 C--N 1.314 -0.965 0 N-CA-C 108.983 -0.747 . . . . 0.0 108.983 -178.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 24.2 m -100.04 142.9 30.9 Favored 'General case' 0 N--CA 1.424 -1.771 0 N-CA-C 108.864 -0.791 . . . . 0.0 108.864 176.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.544 HD11 HD12 ' A' ' 92' ' ' ILE . 36.9 tp -54.57 138.87 39.88 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 124.63 1.172 . . . . 0.0 113.233 176.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ASN . . . . . 0.468 ' OD1' HG13 ' A' ' 89' ' ' VAL . 25.9 t-20 -93.57 86.52 5.22 Favored 'General case' 0 N--CA 1.441 -0.894 0 N-CA-C 107.187 -1.412 . . . . 0.0 107.187 170.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.3 p -73.08 3.83 5.05 Favored 'General case' 0 C--N 1.304 -1.372 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 178.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -77.57 -21.78 51.97 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 116.385 -0.371 . . . . 0.0 111.463 -179.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.468 HG13 ' OD1' ' A' ' 86' ' ' ASN . 32.9 m -78.56 -55.24 10.39 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.895 0 C-N-CA 120.156 -0.617 . . . . 0.0 112.367 -178.463 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.426 HD12 HD13 ' A' ' 50' ' ' LEU . 94.4 mt -140.29 170.37 15.95 Favored 'General case' 0 CA--C 1.5 -0.979 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -175.827 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.415 ' O ' HG12 ' A' ' 92' ' ' ILE . 0.0 OUTLIER -72.97 123.19 23.0 Favored 'General case' 0 CA--C 1.5 -0.963 0 O-C-N 123.876 0.735 . . . . 0.0 112.632 -175.828 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.544 HD12 HD11 ' A' ' 85' ' ' LEU . 2.4 mt -152.32 99.47 0.17 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 N-CA-C 104.733 -2.321 . . . . 0.0 104.733 174.202 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 5.3 m -66.8 136.69 55.84 Favored 'General case' 0 C--N 1.285 -2.21 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.553 -173.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -102.0 26.34 24.68 Favored Glycine 0 CA--C 1.479 -2.203 0 N-CA-C 109.725 -1.35 . . . . 0.0 109.725 -175.025 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -152.44 130.63 11.96 Favored 'General case' 0 N--CA 1.409 -2.515 0 N-CA-C 107.31 -1.367 . . . . 0.0 107.31 174.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.4 t -169.93 -31.62 0.02 OUTLIER 'General case' 0 C--N 1.288 -2.105 0 CA-C-N 115.878 -0.601 . . . . 0.0 109.596 -178.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 65.81 28.54 10.84 Favored 'General case' 0 CA--C 1.505 -0.779 0 CA-C-N 115.337 -0.847 . . . . 0.0 112.448 178.076 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ASN . . . . . . . . . . . . . 42.7 m-80 -105.57 178.63 4.51 Favored 'General case' 0 C--N 1.294 -1.817 0 CA-C-N 115.79 -0.641 . . . . 0.0 109.877 175.204 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -96.81 27.75 3.8 Favored 'General case' 0 C--N 1.296 -1.723 0 N-CA-C 106.667 -1.605 . . . . 0.0 106.667 176.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 6.0 p -63.31 150.35 43.49 Favored 'General case' 0 N--CA 1.43 -1.437 0 CA-C-N 113.004 -1.907 . . . . 0.0 115.797 -171.93 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -134.03 147.53 50.97 Favored 'General case' 0 C--N 1.288 -2.067 0 CA-C-N 113.444 -1.707 . . . . 0.0 106.688 173.686 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -94.48 151.56 19.27 Favored 'General case' 0 C--N 1.306 -1.284 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -172.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -146.71 147.37 30.9 Favored 'General case' 0 N--CA 1.428 -1.565 0 CA-C-N 114.294 -1.321 . . . . 0.0 108.849 -178.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.58 ' O ' ' HA ' ' A' ' 63' ' ' SER . 11.5 mm -76.95 131.06 35.55 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 107.397 -1.335 . . . . 0.0 107.397 177.569 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' SER . . . . . 0.428 ' HA ' ' O ' ' A' ' 62' ' ' ASN . 27.9 t -106.68 -71.23 0.76 Allowed 'General case' 0 N--CA 1.424 -1.732 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 175.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' GLY . . . . . 0.555 ' HA2' ' HB3' ' A' ' 60' ' ' LYS . . . -124.98 -102.22 1.39 Allowed Glycine 0 N--CA 1.413 -2.893 0 N-CA-C 110.486 -1.045 . . . . 0.0 110.486 178.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' ASP . . . . . . . . . . . . . 22.7 m-20 -98.64 2.47 47.29 Favored 'General case' 0 C--N 1.313 -1.02 0 N-CA-C 109.076 -0.713 . . . . 0.0 109.076 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -125.51 162.74 24.22 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.034 -178.616 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.427 ' HB ' HG12 ' A' ' 92' ' ' ILE . 3.8 t -99.37 136.82 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.411 -2.419 0 N-CA-C 105.041 -2.207 . . . . 0.0 105.041 174.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' THR . . . . . . . . . . . . . 39.3 p -125.39 166.47 16.51 Favored 'General case' 0 C--N 1.269 -2.917 0 N-CA-C 108.243 -1.021 . . . . 0.0 108.243 -176.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.8 p90 -138.85 134.15 32.94 Favored 'General case' 0 C--N 1.298 -1.654 0 CA-C-N 118.927 0.785 . . . . 0.0 112.848 -179.152 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLU . . . . . . . . . . . . . 7.8 mm-40 -132.24 179.58 6.03 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.491 -1.231 . . . . 0.0 108.406 -176.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 20.4 m -78.31 129.22 34.77 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 174.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' CYS . . . . . 0.404 ' O ' ' HB ' ' A' ' 26' ' ' THR . 76.6 m -48.21 -18.94 0.24 Allowed 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 126.591 1.956 . . . . 0.0 115.038 -176.543 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -86.37 -3.99 59.09 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 123.525 0.73 . . . . 0.0 110.559 -175.044 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' SER . . . . . . . . . . . . . 25.0 p -77.43 149.59 35.1 Favored 'General case' 0 N--CA 1.434 -1.24 0 C-N-CA 119.965 -0.694 . . . . 0.0 111.069 179.302 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ASP . . . . . . . . . . . . . 37.7 t70 -86.39 93.8 9.21 Favored 'General case' 0 C--N 1.306 -1.323 0 CA-C-N 115.599 -0.728 . . . . 0.0 109.989 -177.123 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -128.35 174.45 9.3 Favored 'General case' 0 C--N 1.295 -1.774 0 CA-C-N 114.804 -1.089 . . . . 0.0 108.523 -178.066 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ARG . . . . . 0.753 ' HB3' ' O ' ' A' ' 21' ' ' SER . 2.5 mpt_? -93.37 -174.5 3.53 Favored 'General case' 0 C--N 1.285 -2.207 0 N-CA-C 106.768 -1.567 . . . . 0.0 106.768 -177.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.425 ' CH2' HG23 ' A' ' 23' ' ' VAL . 28.8 p90 -152.21 167.56 28.19 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 119.864 1.211 . . . . 0.0 111.95 -179.338 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 69.9 mt -125.59 129.85 72.72 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.956 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.451 178.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' CYS . . . . . . . . . . . . . 75.0 m -110.03 150.98 27.75 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 177.331 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLN . . . . . 0.555 ' HA ' ' O ' ' A' ' 17' ' ' CYS . 6.3 pt20 -128.25 140.64 51.78 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 171.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -117.27 115.16 24.74 Favored 'General case' 0 C--N 1.277 -2.556 0 N-CA-C 107.404 -1.332 . . . . 0.0 107.404 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' GLU . . . . . 0.606 ' CD ' ' HA ' ' A' ' 128' ' ' HIS . 41.2 tt0 -74.95 120.69 20.82 Favored 'General case' 0 C--N 1.286 -2.156 0 CA-C-O 121.362 0.601 . . . . 0.0 111.803 -174.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' LEU . . . . . 0.467 ' HB3' HD13 ' A' ' 4' ' ' LEU . 2.8 mm? -73.25 -39.31 65.54 Favored 'General case' 0 CA--C 1.504 -0.814 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.075 179.3 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' TYR . . . . . . . . . . . . . 39.1 p90 -152.41 130.3 11.73 Favored 'General case' 0 CA--C 1.482 -1.66 0 CA-C-N 115.415 -0.811 . . . . 0.0 108.888 177.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' HIS . . . . . 0.606 ' HA ' ' CD ' ' A' ' 125' ' ' GLU . 77.8 t60 -65.71 142.37 58.03 Favored 'General case' 0 C--N 1.3 -1.546 0 O-C-N 124.073 0.858 . . . . 0.0 112.242 -174.166 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -45.6 114.57 0.78 Allowed 'General case' 0 C--O 1.239 0.503 0 O-C-N 124.896 1.372 . . . . 0.0 108.784 173.791 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' THR . . . . . . . . . . . . . 25.6 m -62.86 133.14 54.24 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.024 -0.989 . . . . 0.0 112.551 -170.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -83.36 158.07 22.3 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 115.014 -0.994 . . . . 0.0 109.337 -176.318 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 4.0 p -72.05 108.59 5.35 Favored 'General case' 0 N--CA 1.43 -1.47 0 CA-C-O 121.427 0.632 . . . . 0.0 112.222 -177.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' ASN . . . . . . . . . . . . 0.286 20.6 m120 78.04 -84.33 0.02 OUTLIER 'General case' 0 CA--C 1.493 -1.249 0 C-N-CA 125.291 1.437 . . . . 0.0 114.189 179.653 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 76.5 m-85 -129.02 169.26 14.91 Favored 'General case' 0 C--N 1.29 -2.017 0 C-N-CA 120.056 -0.658 . . . . 0.0 112.28 -173.385 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' VAL . . . . . 0.439 ' O ' ' HA ' ' A' ' 139' ' ' HIS . 48.9 t -113.23 -38.05 2.8 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.978 0 CA-C-N 115.109 -0.95 . . . . 0.0 108.624 177.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' GLY . . . . . . . . . . . . . . . 80.65 -133.77 12.59 Favored Glycine 0 N--CA 1.444 -0.793 0 C-N-CA 120.898 -0.668 . . . . 0.0 112.169 177.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 95.6 m-85 -128.63 16.83 6.42 Favored 'General case' 0 N--CA 1.478 0.958 0 CA-C-O 122.51 1.148 . . . . 0.0 109.125 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' GLY . . . . . . . . . . . . . . . 168.94 -46.95 0.22 Allowed Glycine 0 CA--C 1.478 -2.222 0 N-CA-C 104.743 -3.343 . . . . 0.0 104.743 -177.281 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' HIS . . . . . 0.439 ' HA ' ' O ' ' A' ' 135' ' ' VAL . 5.2 t60 . . . . . 0 N--CA 1.419 -2.017 0 N-CA-C 103.158 -2.904 . . . . 0.0 103.158 168.716 . . . . . . . . 1 1 . 1 stop_ save_